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

Systemtic Name: 4-azanyl-3-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]benzoic acid Openeye Name: 4-amino-3-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]benzoic acid CAS Name: 4-amino-3-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]benzoic acid IUPAC Name: 4-amino-3-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]benzoic acid Traditional Name: 4-amino-3-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]benzoic acid Formula: C15H18N2O3 MolecularWeight: 274.31502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=C(C=CC(=C2)C(=O)O)N)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=C(C=CC(=C2)C(=O)O)N)C

InChI

InChI=1S/C15H18N2O3/c1-15(2)7-10(6-11(18)8-15)17-13-5-9(14(19)20)3-4-12(13)16/h3-6,17H,7-8,16H2,1-2H3,(H,19,20)