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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)OC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)OC

InChI

InChI=1S/C27H25BrN2O2/c1-5-18-13-20(28)9-10-24(18)30-27(31)23-15-25(19-7-6-8-21(14-19)32-4)29-26-17(3)11-16(2)12-22(23)26/h6-15H,5H2,1-4H3,(H,30,31)