2-[(2-methylphenyl)-propylsulfonyl-amino]ethanoate

Systemtic Name: 2-[(2-methylphenyl)-propylsulfonyl-amino]ethanoate Openeye Name: 2-(2-methyl-N-propylsulfonyl-anilino)acetate CAS Name: 2-(2-methyl-N-propylsulfonylanilino)acetate IUPAC Name: 2-(2-methyl-N-propylsulfonylanilino)acetate Traditional Name: 2-(2-methyl-N-propylsulfonyl-anilino)acetate Formula: C12H16NO4S- MolecularWeight: 270.32474

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CC(=O)[O-])C1=CC=CC=C1C

Isomeric SMILES

CCCS(=O)(=O)N(CC(=O)[O-])C1=CC=CC=C1C

InChI

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