2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(4-sulfamoylphenyl)acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazin-1-iumyl]-N-(4-sulfamoylphenyl)acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(4-sulfamoylphenyl)acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(4-sulfamoylphenyl)acetamide Formula: C19H25N4O3S+ MolecularWeight: 389.4918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C19H24N4O3S/c20-27(25,26)18-8-6-17(7-9-18)21-19(24)15-23-12-10-22(11-13-23)14-16-4-2-1-3-5-16/h1-9H,10-15H2,(H,21,24)(H2,20,25,26)/p+1