N-(phenylmethyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-(phenylmethyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-benzyl-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-(phenylmethyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-benzyl-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-benzyl-1-(3,4,5-trimethoxyphenyl)-9H-$b-carboline-3-carboxamide Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C3C(=CC(=N2)C(=O)NCC4=CC=CC=C4)C5=CC=CC=C5N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C3C(=CC(=N2)C(=O)NCC4=CC=CC=C4)C5=CC=CC=C5N3

InChI

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