2-(3-chlorophenyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-3-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(3-chlorophenyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-3-methyl-quinoline-4-carboxamide Openeye Name: 2-(3-chlorophenyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-3-methyl-quinoline-4-carboxamide CAS Name: 2-(3-chlorophenyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-3-methyl-4-quinolinecarboxamide IUPAC Name: 2-(3-chlorophenyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-3-methylquinoline-4-carboxamide Traditional Name: 2-(3-chlorophenyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-3-methyl-cinchoninamide Formula: C27H25ClN2O MolecularWeight: 428.9532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC(=CC=C4)Cl)C)C

InChI

InChI=1S/C27H25ClN2O/c1-16-12-13-20(14-17(16)2)19(4)29-27(31)25-18(3)26(21-8-7-9-22(28)15-21)30-24-11-6-5-10-23(24)25/h5-15,19H,1-4H3,(H,29,31)/t19-/m0/s1