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

Systemtic Name: 4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-morpholinosulfonyl-benzamide CAS Name: 4-ethyl-N-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: 4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-ethyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]-3-morpholinosulfonyl-benzamide Formula: C27H38N3O4S+ MolecularWeight: 500.67332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCC(CC3)C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCC(CC3)C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C27H37N3O4S/c1-3-24-8-9-25(18-26(24)35(32,33)30-14-16-34-17-15-30)27(31)28-19-22-4-6-23(7-5-22)20-29-12-10-21(2)11-13-29/h4-9,18,21H,3,10-17,19-20H2,1-2H3,(H,28,31)/p+1