1-(2-methoxyphenyl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(2-methoxyphenyl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(2-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(2-methoxyphenyl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(2-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(2-methoxyphenyl)-9H-$b-carboline-3-carboxamide Formula: C31H31N4O2+ MolecularWeight: 491.60344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NC4CC[NH+](CC4)CC5=CC=CC=C5)C6=CC=CC=C6N3

Isomeric SMILES

COC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NC4CC[NH+](CC4)CC5=CC=CC=C5)C6=CC=CC=C6N3

InChI

InChI=1S/C31H30N4O2/c1-37-28-14-8-6-12-24(28)29-30-25(23-11-5-7-13-26(23)33-30)19-27(34-29)31(36)32-22-15-17-35(18-16-22)20-21-9-3-2-4-10-21/h2-14,19,22,33H,15-18,20H2,1H3,(H,32,36)/p+1