2-[3-[methyl-(phenylmethyl)azaniumyl]propylsulfamoyl]ethanoate

Systemtic Name: 2-[3-[methyl-(phenylmethyl)azaniumyl]propylsulfamoyl]ethanoate Openeye Name: 2-[3-[benzyl(methyl)ammonio]propylsulfamoyl]acetate CAS Name: 2-[3-[methyl-(phenylmethyl)ammonio]propylsulfamoyl]acetate IUPAC Name: 2-[3-[benzyl(methyl)azaniumyl]propylsulfamoyl]acetate Traditional Name: 2-[3-[benzyl(methyl)ammonio]propylsulfamoyl]acetate Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4S/c1-15(10-12-6-3-2-4-7-12)9-5-8-14-20(18,19)11-13(16)17/h2-4,6-7,14H,5,8-11H2,1H3,(H,16,17)