(2-oxidanylidene-1,2-diphenyl-ethyl) 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid desyl ester Formula: C31H22ClNO3 MolecularWeight: 491.96428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OC(C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OC(C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H22ClNO3/c1-20-27(25-17-8-9-18-26(25)33-28(20)23-15-10-16-24(32)19-23)31(35)36-30(22-13-6-3-7-14-22)29(34)21-11-4-2-5-12-21/h2-19,30H,1H3