5-(cyclopropylsulfamoyl)-2-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide

Systemtic Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-(cyclopropylsulfamoyl)-2-methyl-benzamide CAS Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-(cyclopropylsulfamoyl)-2-methyl-benzamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3S/c1-17-7-10-21(30(28,29)25-20-8-9-20)15-22(17)23(27)24-19-11-13-26(14-12-19)16-18-5-3-2-4-6-18/h2-7,10,15,19-20,25H,8-9,11-14,16H2,1H3,(H,24,27)/p+1