2-[(3-chlorophenyl)-propylsulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(3-chlorophenyl)-propylsulfonyl-amino]ethanoic acid Openeye Name: 2-(3-chloro-N-propylsulfonyl-anilino)acetic acid CAS Name: 2-(3-chloro-N-propylsulfonylanilino)acetic acid IUPAC Name: 2-(3-chloro-N-propylsulfonylanilino)acetic acid Traditional Name: 2-(3-chloro-N-propylsulfonyl-anilino)acetic acid Formula: C11H14ClNO4S MolecularWeight: 291.75116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14ClNO4S/c1-2-6-18(16,17)13(8-11(14)15)10-5-3-4-9(12)7-10/h3-5,7H,2,6,8H2,1H3,(H,14,15)