2-(4-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-6-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-6-methyl-quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-6-methyl-quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-6-methyl-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-6-methylquinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-[1-(3,4-dimethylphenyl)ethyl]-6-methyl-cinchoninamide Formula: C27H25BrN2O MolecularWeight: 473.4042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(C)C3=CC(=C(C=C3)C)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(C)C3=CC(=C(C=C3)C)C)C4=CC=C(C=C4)Br

InChI

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