6-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-homoveratryl-2-(p-tolyl)cinchoninamide Formula: C27H25BrN2O3 MolecularWeight: 505.403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H25BrN2O3/c1-17-4-7-19(8-5-17)24-16-22(21-15-20(28)9-10-23(21)30-24)27(31)29-13-12-18-6-11-25(32-2)26(14-18)33-3/h4-11,14-16H,12-13H2,1-3H3,(H,29,31)