3-[(4-chlorophenyl)-ethylsulfonyl-amino]propanoate

Systemtic Name: 3-[(4-chlorophenyl)-ethylsulfonyl-amino]propanoate Openeye Name: 3-(4-chloro-N-ethylsulfonyl-anilino)propanoate CAS Name: 3-(4-chloro-N-ethylsulfonylanilino)propanoate IUPAC Name: 3-(4-chloro-N-ethylsulfonylanilino)propanoate Traditional Name: 3-(4-chloro-N-esyl-anilino)propionate Formula: C11H13ClNO4S- MolecularWeight: 290.74322

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CCC(=O)[O-])C1=CC=C(C=C1)Cl

Isomeric SMILES

CCS(=O)(=O)N(CCC(=O)[O-])C1=CC=C(C=C1)Cl

InChI

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