3-[ethylsulfonyl-(4-methylphenyl)amino]propanoic acid

Systemtic Name: 3-[ethylsulfonyl-(4-methylphenyl)amino]propanoic acid Openeye Name: 3-(N-ethylsulfonyl-4-methyl-anilino)propanoic acid CAS Name: 3-(N-ethylsulfonyl-4-methylanilino)propanoic acid IUPAC Name: 3-(N-ethylsulfonyl-4-methylanilino)propanoic acid Traditional Name: 3-(N-esyl-4-methyl-anilino)propionic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CCC(=O)O)C1=CC=C(C=C1)C

Isomeric SMILES

CCS(=O)(=O)N(CCC(=O)O)C1=CC=C(C=C1)C

InChI

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