2-[4-(4-methylpiperidin-1-yl)sulfonyl-1,4-diazepan-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(4-methylpiperidin-1-yl)sulfonyl-1,4-diazepan-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[(4-methyl-1-piperidyl)sulfonyl]-1,4-diazepan-1-ium-1-yl]acetamide CAS Name: 2-[4-[(4-methyl-1-piperidinyl)sulfonyl]-1,4-diazepan-1-ium-1-yl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(4-methylpiperidin-1-yl)sulfonyl-1,4-diazepan-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-(4-methylpiperidino)sulfonyl-1,4-diazepan-1-ium-1-yl]acetamide Formula: C16H33N4O3S+ MolecularWeight: 361.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CCC[NH+](CC2)CC(=O)NC(C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CCC[NH+](CC2)CC(=O)NC(C)C

InChI

InChI=1S/C16H32N4O3S/c1-14(2)17-16(21)13-18-7-4-8-19(12-11-18)24(22,23)20-9-5-15(3)6-10-20/h14-15H,4-13H2,1-3H3,(H,17,21)/p+1