N-[(3,4-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(4-methoxyphenyl)-N-veratryl-9H-$b-carboline-3-carboxamide Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCC4=CC(=C(C=C4)OC)OC)C5=CC=CC=C5N3

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCC4=CC(=C(C=C4)OC)OC)C5=CC=CC=C5N3

InChI

InChI=1S/C28H25N3O4/c1-33-19-11-9-18(10-12-19)26-27-21(20-6-4-5-7-22(20)30-27)15-23(31-26)28(32)29-16-17-8-13-24(34-2)25(14-17)35-3/h4-15,30H,16H2,1-3H3,(H,29,32)