2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(1-benzylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(1-benzylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(1-benzylpiperidin-1-ium-4-yl)acetamide Formula: C26H42N4O2+2 MolecularWeight: 442.63728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H40N4O2/c31-25(27-24-12-18-28(19-13-24)20-22-8-4-3-5-9-22)21-29-16-10-23(11-17-29)26(32)30-14-6-1-2-7-15-30/h3-5,8-9,23-24H,1-2,6-7,10-21H2,(H,27,31)/p+2