N-(4-bromanyl-3,5-dimethyl-phenyl)-6,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(4-bromanyl-3,5-dimethyl-phenyl)-6,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(4-bromo-3,5-dimethyl-phenyl)-6,8-dimethyl-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-(4-bromo-3,5-dimethylphenyl)-6,8-dimethyl-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(4-bromo-3,5-dimethylphenyl)-6,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(4-bromo-3,5-dimethyl-phenyl)-6,8-dimethyl-2-(p-tolyl)cinchoninamide Formula: C27H25BrN2O MolecularWeight: 473.4042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4=CC(=C(C(=C4)C)Br)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4=CC(=C(C(=C4)C)Br)C)C)C

InChI

InChI=1S/C27H25BrN2O/c1-15-6-8-20(9-7-15)24-14-23(22-11-16(2)10-19(5)26(22)30-24)27(31)29-21-12-17(3)25(28)18(4)13-21/h6-14H,1-5H3,(H,29,31)