4-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 4-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-morpholinosulfonyl-benzamide CAS Name: 4-methyl-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: 4-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-morpholinosulfonyl-benzamide Formula: C21H34N3O4S+ MolecularWeight: 424.57736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H33N3O4S/c1-17-6-10-23(11-7-17)9-3-8-22-21(25)19-5-4-18(2)20(16-19)29(26,27)24-12-14-28-15-13-24/h4-5,16-17H,3,6-15H2,1-2H3,(H,22,25)/p+1