3-[(3-fluorophenyl)-propylsulfonyl-amino]propanoate

Systemtic Name: 3-[(3-fluorophenyl)-propylsulfonyl-amino]propanoate Openeye Name: 3-(3-fluoro-N-propylsulfonyl-anilino)propanoate CAS Name: 3-(3-fluoro-N-propylsulfonylanilino)propanoate IUPAC Name: 3-(3-fluoro-N-propylsulfonylanilino)propanoate Traditional Name: 3-(3-fluoro-N-propylsulfonyl-anilino)propionate Formula: C12H15FNO4S- MolecularWeight: 288.315203

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CCC(=O)[O-])C1=CC(=CC=C1)F

Isomeric SMILES

CCCS(=O)(=O)N(CCC(=O)[O-])C1=CC(=CC=C1)F

InChI

InChI=1S/C12H16FNO4S/c1-2-8-19(17,18)14(7-6-12(15)16)11-5-3-4-10(13)9-11/h3-5,9H,2,6-8H2,1H3,(H,15,16)/p-1