1-(2,4-dimethoxyphenyl)-N-(2-oxidanyl-2-phenyl-ethyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(2,4-dimethoxyphenyl)-N-(2-oxidanyl-2-phenyl-ethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(2,4-dimethoxyphenyl)-N-(2-hydroxy-2-phenyl-ethyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(2,4-dimethoxyphenyl)-N-(2-hydroxy-2-phenylethyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(2,4-dimethoxyphenyl)-N-(2-hydroxy-2-phenylethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(2,4-dimethoxyphenyl)-N-(2-hydroxy-2-phenyl-ethyl)-9H-$b-carboline-3-carboxamide Formula: C28H25N3O4 MolecularWeight: 467.5158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCC(C4=CC=CC=C4)O)C5=CC=CC=C5N3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCC(C4=CC=CC=C4)O)C5=CC=CC=C5N3)OC

InChI

InChI=1S/C28H25N3O4/c1-34-18-12-13-20(25(14-18)35-2)26-27-21(19-10-6-7-11-22(19)30-27)15-23(31-26)28(33)29-16-24(32)17-8-4-3-5-9-17/h3-15,24,30,32H,16H2,1-2H3,(H,29,33)