2-(3-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-8-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(3-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-8-methyl-quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-8-methyl-quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-8-methyl-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-8-methylquinoline-4-carboxamide Traditional Name: 2-(3-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-8-methyl-cinchoninamide Formula: C27H25BrN2O MolecularWeight: 473.4042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC(=CC=C4)Br)C

InChI

InChI=1S/C27H25BrN2O/c1-16-11-12-20(13-18(16)3)19(4)29-27(31)24-15-25(21-8-6-9-22(28)14-21)30-26-17(2)7-5-10-23(24)26/h5-15,19H,1-4H3,(H,29,31)