4-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-benzoic acid Openeye Name: 4-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-benzoic acid CAS Name: 4-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-methylbenzoic acid IUPAC Name: 4-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-methylbenzoic acid Traditional Name: 4-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-benzoic acid Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=C(C=C(C=C2)C(=O)O)C)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNC2=C(C=C(C=C2)C(=O)O)C)C=C(C1=O)C

InChI

InChI=1S/C17H17NO3/c1-10-8-14(17(20)21)4-5-15(10)18-9-13-6-11(2)16(19)12(3)7-13/h4-9,18H,1-3H3,(H,20,21)