4-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]benzoate

Systemtic Name: 4-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]benzoate Openeye Name: 4-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]benzoate CAS Name: 4-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]benzoate IUPAC Name: 4-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]benzoate Traditional Name: 4-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]benzoate Formula: C15H16NO3- MolecularWeight: 258.29244

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=CC=C(C=C2)C(=O)[O-])C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=CC=C(C=C2)C(=O)[O-])C

InChI

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