N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-18-7-6-14-25(15-18)17-22(26)23-20-10-12-21(13-11-20)29(27,28)24(2)16-19-8-4-3-5-9-19/h3-5,8-13,18H,6-7,14-17H2,1-2H3,(H,23,26)/p+1/t18-/m0/s1