2-methyl-5-morpholin-4-ylsulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2-methyl-5-morpholin-4-ylsulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-methyl-5-morpholinosulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-methyl-5-morpholin-4-ylsulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-methyl-5-morpholinosulfonyl-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C25H34N3O4S+ MolecularWeight: 472.62016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-20-9-10-23(33(30,31)28-13-15-32-16-14-28)17-24(20)25(29)26-18-21-7-3-4-8-22(21)19-27-11-5-2-6-12-27/h3-4,7-10,17H,2,5-6,11-16,18-19H2,1H3,(H,26,29)/p+1