3-[3-[methyl-(phenylmethyl)azaniumyl]propylsulfamoyl]propanoate

Systemtic Name: 3-[3-[methyl-(phenylmethyl)azaniumyl]propylsulfamoyl]propanoate Openeye Name: 3-[3-[benzyl(methyl)ammonio]propylsulfamoyl]propanoate CAS Name: 3-[3-[methyl-(phenylmethyl)ammonio]propylsulfamoyl]propanoate IUPAC Name: 3-[3-[benzyl(methyl)azaniumyl]propylsulfamoyl]propanoate Traditional Name: 3-[3-[benzyl(methyl)ammonio]propylsulfamoyl]propionate Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNS(=O)(=O)CCC(=O)[O-])CC1=CC=CC=C1

Isomeric SMILES

C[NH+](CCCNS(=O)(=O)CCC(=O)[O-])CC1=CC=CC=C1

InChI

InChI=1S/C14H22N2O4S/c1-16(12-13-6-3-2-4-7-13)10-5-9-15-21(19,20)11-8-14(17)18/h2-4,6-7,15H,5,8-12H2,1H3,(H,17,18)