N-(2-morpholin-4-ylethyl)-N'-[[1-(phenylmethyl)piperidin-1-ium-4-yl]methyl]ethanediamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-N'-[[1-(phenylmethyl)piperidin-1-ium-4-yl]methyl]ethanediamide Openeye Name: N'-[(1-benzylpiperidin-1-ium-4-yl)methyl]-N-(2-morpholinoethyl)oxamide CAS Name: N-[2-(4-morpholinyl)ethyl]-N'-[[1-(phenylmethyl)-4-piperidin-1-iumyl]methyl]oxamide IUPAC Name: N'-[(1-benzylpiperidin-1-ium-4-yl)methyl]-N-(2-morpholin-4-ylethyl)oxamide Traditional Name: N'-[(1-benzylpiperidin-1-ium-4-yl)methyl]-N-(2-morpholinoethyl)oxamide Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CNC(=O)C(=O)NCCN2CCOCC2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1CNC(=O)C(=O)NCCN2CCOCC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H32N4O3/c26-20(22-8-11-24-12-14-28-15-13-24)21(27)23-16-18-6-9-25(10-7-18)17-19-4-2-1-3-5-19/h1-5,18H,6-17H2,(H,22,26)(H,23,27)/p+1