3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanamide CAS Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propionamide Formula: C30H34N3O2+ MolecularWeight: 468.60986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)NC4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)NC4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O2/c1-35-25-13-11-23(12-14-25)30-27(26-9-5-6-10-28(26)32-30)15-16-29(34)31-24-17-19-33(20-18-24)21-22-7-3-2-4-8-22/h2-14,24,32H,15-21H2,1H3,(H,31,34)/p+1