4-(4-methylpiperidin-1-yl)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-(4-methylpiperidin-1-yl)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 4-[(4-methyl-1-piperidyl)sulfonyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-(4-methylpiperidin-1-yl)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 4-(4-methylpiperidino)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C20H32N3O4S+ MolecularWeight: 410.55078

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C20H31N3O4S/c1-17-7-11-23(12-8-17)28(25,26)19-5-3-18(4-6-19)20(24)21-9-2-10-22-13-15-27-16-14-22/h3-6,17H,2,7-16H2,1H3,(H,21,24)/p+1