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

Systemtic Name: 3-[2-[(1E)-1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethyl]hydrazinyl]benzoic acid Openeye Name: 3-[2-[(1E)-1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethyl]hydrazino]benzoic acid CAS Name: 3-[[(1E)-1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)ethyl]hydrazo]benzoic acid IUPAC Name: 3-[2-[(1E)-1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]hydrazinyl]benzoic acid Traditional Name: 3-[N'-[(1E)-1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)ethyl]hydrazino]benzoic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C)NNC2=CC=CC(=C2)C(=O)O)C(=O)C=C1

Isomeric SMILES

CC1=C/C(=C(/C)\NNC2=CC=CC(=C2)C(=O)O)/C(=O)C=C1

InChI

InChI=1S/C16H16N2O3/c1-10-6-7-15(19)14(8-10)11(2)17-18-13-5-3-4-12(9-13)16(20)21/h3-9,17-18H,1-2H3,(H,20,21)/b14-11+