N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-17-8-7-13-24(15-17)16-21(25)22-18-9-6-12-20(14-18)28(26,27)23(2)19-10-4-3-5-11-19/h3-6,9-12,14,17H,7-8,13,15-16H2,1-2H3,(H,22,25)/p+1/t17-/m0/s1