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

Systemtic Name: N-(4-bromanyl-3,5-dimethyl-phenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-N-(4-bromo-3,5-dimethyl-phenyl)-3,6,8-trimethyl-quinoline-4-carboxamide CAS Name: N-(4-bromo-3,5-dimethylphenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(4-bromo-3,5-dimethylphenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-N-(4-bromo-3,5-dimethyl-phenyl)-3,6,8-trimethyl-cinchoninamide Formula: C34H31BrN2O2 MolecularWeight: 579.52614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=CC(=C(C(=C5)C)Br)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=CC(=C(C(=C5)C)Br)C)C

InChI

InChI=1S/C34H31BrN2O2/c1-20-15-23(4)32-29(16-20)30(34(38)36-27-17-21(2)31(35)22(3)18-27)24(5)33(37-32)26-11-13-28(14-12-26)39-19-25-9-7-6-8-10-25/h6-18H,19H2,1-5H3,(H,36,38)