2-[(4-methylphenyl)-propylsulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(4-methylphenyl)-propylsulfonyl-amino]ethanoic acid Openeye Name: 2-(4-methyl-N-propylsulfonyl-anilino)acetic acid CAS Name: 2-(4-methyl-N-propylsulfonylanilino)acetic acid IUPAC Name: 2-(4-methyl-N-propylsulfonylanilino)acetic acid Traditional Name: 2-(4-methyl-N-propylsulfonyl-anilino)acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4S/c1-3-8-18(16,17)13(9-12(14)15)11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3,(H,14,15)