2-(3,4-dimethoxyphenyl)-N-[2-(dimethylamino)-2-phenyl-ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[2-(dimethylamino)-2-phenyl-ethyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[2-(dimethylamino)-2-phenyl-ethyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[2-(dimethylamino)-2-phenylethyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[2-(dimethylamino)-2-phenylethyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[2-(dimethylamino)-2-phenyl-ethyl]cinchoninamide Formula: C28H29N3O3 MolecularWeight: 455.54816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3/c1-31(2)25(19-10-6-5-7-11-19)18-29-28(32)22-17-24(30-23-13-9-8-12-21(22)23)20-14-15-26(33-3)27(16-20)34-4/h5-17,25H,18H2,1-4H3,(H,29,32)