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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > nsc-277184

Preferred term

nsc-277184  

Type

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

Broader concept

charge

  • 0

formula

  • C18H20N4O4.H2O4S

inchi

  • InChI=1S/C18H20N4O4.H2O4S/c1-20(2)6-7-26-14-5-4-12-8-13(18(23)15(12)10-14)9-16-19-11-17(21(16)3)22(24)25;1-5(2,3)4/h4-5,9-11H,6-8H2,1-3H3;(H2,1,2,3,4)/b13-9-;

inchikey

  • QCDIRNSCHKOUIQ-CHHCPSLASA-N

mass

  • 454.450

monoisotopicmass

  • 454.11583

smiles

  • CN(C)CCOC=1C=CC=2C/C(=C(/[H])/C3=NC=C(N3C)[N+]([O-])=O)/C(C2C1)=O.OS(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • (2Z)-6-[2-(dimethylamino)ethoxy]-2-[(1-methyl-5-nitroimidazol-2-yl)methylidene]-3H-inden-1-one;sulfuric acid

synonym RELATED

  • MLS003115472

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:232812

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