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

Systemtic Name: N-(4-bromanyl-3,5-dimethyl-phenyl)-2-(3-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxamide Openeye Name: N-(4-bromo-3,5-dimethyl-phenyl)-2-(3-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxamide CAS Name: N-(4-bromo-3,5-dimethylphenyl)-2-(3-methoxyphenyl)-6,8-dimethyl-4-quinolinecarboxamide IUPAC Name: N-(4-bromo-3,5-dimethylphenyl)-2-(3-methoxyphenyl)-6,8-dimethylquinoline-4-carboxamide Traditional Name: N-(4-bromo-3,5-dimethyl-phenyl)-2-(3-methoxyphenyl)-6,8-dimethyl-cinchoninamide Formula: C27H25BrN2O2 MolecularWeight: 489.4036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)NC4=CC(=C(C(=C4)C)Br)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)NC4=CC(=C(C(=C4)C)Br)C)C

InChI

InChI=1S/C27H25BrN2O2/c1-15-9-18(4)26-22(10-15)23(14-24(30-26)19-7-6-8-21(13-19)32-5)27(31)29-20-11-16(2)25(28)17(3)12-20/h6-14H,1-5H3,(H,29,31)