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

Systemtic Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Openeye Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide CAS Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[3-(1-piperidin-1-iumyl)propyl]propanamide IUPAC Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Traditional Name: 3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(3-piperidin-1-ium-1-ylpropyl)propionamide Formula: C26H34N3O2+ MolecularWeight: 420.56706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)NCCC[NH+]4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)NCCC[NH+]4CCCCC4

InChI

InChI=1S/C26H33N3O2/c1-31-21-12-10-20(11-13-21)26-23(22-8-3-4-9-24(22)28-26)14-15-25(30)27-16-7-19-29-17-5-2-6-18-29/h3-4,8-13,28H,2,5-7,14-19H2,1H3,(H,27,30)/p+1