N-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-9H-$b-carboline-3-carboxamide Formula: C29H27N3O2 MolecularWeight: 449.54358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)CCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)CCC5=CC=CC=C5

InChI

InChI=1S/C29H27N3O2/c1-34-22-14-11-21(12-15-22)17-18-30-29(33)27-19-24-23-9-5-6-10-25(23)32-28(24)26(31-27)16-13-20-7-3-2-4-8-20/h2-12,14-15,19,32H,13,16-18H2,1H3,(H,30,33)