4-[(2E)-2-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-3-nitro-benzoic acid

Systemtic Name: 4-[(2E)-2-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-3-nitro-benzoic acid Openeye Name: 4-[(2E)-2-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]-3-nitro-benzoic acid CAS Name: 4-[(2E)-2-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]-3-nitrobenzoic acid IUPAC Name: 4-[(2E)-2-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-3-nitrobenzoic acid Traditional Name: 4-[(N'E)-N'-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)hydrazino]-3-nitro-benzoic acid Formula: C14H11N3O5 MolecularWeight: 301.25424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])C(=O)C=C1

Isomeric SMILES

CC1=C/C(=N\NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])/C(=O)C=C1

InChI

InChI=1S/C14H11N3O5/c1-8-2-5-13(18)11(6-8)16-15-10-4-3-9(14(19)20)7-12(10)17(21)22/h2-7,15H,1H3,(H,19,20)/b16-11+