4-[(4,4-dimethyl-2-oxidanylidene-1-propyl-3H-quinolin-7-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(4,4-dimethyl-2-oxidanylidene-1-propyl-3H-quinolin-7-yl)carbonylamino]benzoic acid Openeye Name: 4-[(4,4-dimethyl-2-oxo-1-propyl-3H-quinoline-7-carbonyl)amino]benzoic acid CAS Name: 4-[[(4,4-dimethyl-2-oxo-1-propyl-3H-quinolin-7-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(4,4-dimethyl-2-oxo-1-propyl-3H-quinoline-7-carbonyl)amino]benzoic acid Traditional Name: 4-[(2-keto-4,4-dimethyl-1-propyl-3H-quinoline-7-carbonyl)amino]benzoic acid Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)CC(C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CCCN1C(=O)CC(C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C22H24N2O4/c1-4-11-24-18-12-15(7-10-17(18)22(2,3)13-19(24)25)20(26)23-16-8-5-14(6-9-16)21(27)28/h5-10,12H,4,11,13H2,1-3H3,(H,23,26)(H,27,28)