7-[(2E)-2-[(2-nitro-5-oxidanyl-phenyl)methylidene]hydrazinyl]-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-[(2E)-2-[(2-nitro-5-oxidanyl-phenyl)methylidene]hydrazinyl]-7-oxidanylidene-heptanoic acid Openeye Name: 7-[(2E)-2-[(5-hydroxy-2-nitro-phenyl)methylene]hydrazino]-7-oxo-heptanoic acid CAS Name: 7-[(2E)-2-[(5-hydroxy-2-nitrophenyl)methylidene]hydrazinyl]-7-oxoheptanoic acid IUPAC Name: 7-[(2E)-2-[(5-hydroxy-2-nitrophenyl)methylidene]hydrazinyl]-7-oxoheptanoic acid Traditional Name: 7-[(N'E)-N'-(5-hydroxy-2-nitro-benzylidene)hydrazino]-7-keto-enanthic acid Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C=NNC(=O)CCCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1O)/C=N/NC(=O)CCCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c18-11-6-7-12(17(22)23)10(8-11)9-15-16-13(19)4-2-1-3-5-14(20)21/h6-9,18H,1-5H2,(H,16,19)(H,20,21)/b15-9+