methyl 4-methyl-3-[(2-phenylquinolin-4-yl)carbonylamino]benzoate hydrochloride

Systemtic Name: methyl 4-methyl-3-[(2-phenylquinolin-4-yl)carbonylamino]benzoate hydrochloride Openeye Name: methyl 4-methyl-3-[(2-phenylquinoline-4-carbonyl)amino]benzoate hydrochloride CAS Name: 4-methyl-3-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 4-methyl-3-[(2-phenylquinoline-4-carbonyl)amino]benzoate hydrochloride Traditional Name: 4-methyl-3-[(2-phenylquinoline-4-carbonyl)amino]benzoic acid methyl ester hydrochloride Formula: C25H21ClN2O3 MolecularWeight: 432.89884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H20N2O3.ClH/c1-16-12-13-18(25(29)30-2)14-22(16)27-24(28)20-15-23(17-8-4-3-5-9-17)26-21-11-7-6-10-19(20)21;/h3-15H,1-2H3,(H,27,28);1H