2-[(phenylmethyl)-propylsulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(phenylmethyl)-propylsulfonyl-amino]ethanoic acid Openeye Name: 2-[benzyl(propylsulfonyl)amino]acetic acid CAS Name: 2-[(phenylmethyl)-propylsulfonylamino]acetic acid IUPAC Name: 2-[benzyl(propylsulfonyl)amino]acetic acid Traditional Name: 2-[benzyl(propylsulfonyl)amino]acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CC1=CC=CC=C1)CC(=O)O

Isomeric SMILES

CCCS(=O)(=O)N(CC1=CC=CC=C1)CC(=O)O

InChI

InChI=1S/C12H17NO4S/c1-2-8-18(16,17)13(10-12(14)15)9-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,14,15)