(2R)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2R)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(4-sulfamoylphenyl)propanamide CAS Name: (2R)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(4-sulfamoylphenyl)propionamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-16(21(25)23-19-7-9-20(10-8-19)28(22,26)27)24-13-11-18(12-14-24)15-17-5-3-2-4-6-17/h2-10,16,18H,11-15H2,1H3,(H,23,25)(H2,22,26,27)/p+1/t16-/m1/s1