2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Formula: C24H35N4O2+ MolecularWeight: 411.5603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H34N4O2/c29-23(25-12-9-20-17-26-22-8-4-3-7-21(20)22)18-27-15-10-19(11-16-27)24(30)28-13-5-1-2-6-14-28/h3-4,7-8,17,19,26H,1-2,5-6,9-16,18H2,(H,25,29)/p+1