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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=CC=CC(=C2C)C(=O)O)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNC2=CC=CC(=C2C)C(=O)O)C=C(C1=O)C

InChI

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