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

Systemtic Name: 1-phenyl-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-phenyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-phenyl-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-phenyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-phenyl-9H-$b-carboline-3-carboxamide Formula: C30H29N4O+ MolecularWeight: 461.57746

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C30H28N4O/c35-30(31-23-15-17-34(18-16-23)20-21-9-3-1-4-10-21)27-19-25-24-13-7-8-14-26(24)32-29(25)28(33-27)22-11-5-2-6-12-22/h1-14,19,23,32H,15-18,20H2,(H,31,35)/p+1