2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]benzoic acid

Systemtic Name: 2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]benzoic acid Openeye Name: 2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]benzoic acid CAS Name: 2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]benzoic acid IUPAC Name: 2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]benzoic acid Traditional Name: 2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]benzoic acid Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C15H17NO3/c1-15(2)8-10(7-11(17)9-15)16-13-6-4-3-5-12(13)14(18)19/h3-7,16H,8-9H2,1-2H3,(H,18,19)