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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 2-bromobenzoic acid [[amino-(4-nitrophenyl)methylidene]amino] ester
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > organohalogen compound > 2-bromobenzoic acid [[amino-(4-nitrophenyl)methylidene]amino] ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > halogen molecular entity > halide > organohalogen compound > 2-bromobenzoic acid [[amino-(4-nitrophenyl)methylidene]amino] ester

Preferred term

2-bromobenzoic acid [[amino-(4-nitrophenyl)methylidene]amino] ester  

Type

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

charge

  • 0

formula

  • C14H10BrN3O4

inchi

  • InChI=1S/C14H10BrN3O4/c15-12-4-2-1-3-11(12)14(19)22-17-13(16)9-5-7-10(8-6-9)18(20)21/h1-8H,(H2,16,17)

inchikey

  • QWBZEMYFWMWFBB-UHFFFAOYSA-N

mass

  • 364.151

monoisotopicmass

  • 362.98547

smiles

  • C1=CC=C(C(=C1)C(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])N)Br

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:115041

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