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Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester

Preferred term

3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C18H15NO3S

inchi

  • InChI=1S/C18H15NO3S/c20-15(13-6-2-1-3-7-13)12-22-18(21)11-10-17-19-14-8-4-5-9-16(14)23-17/h1-9H,10-12H2

inchikey

  • TURJQVVMDZYPPL-UHFFFAOYSA-N

mass

  • 325.383

monoisotopicmass

  • 325.07726

smiles

  • C1=CC=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3S2

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120510

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