3-[ethyl-(4-fluoranyl-2-methyl-phenyl)sulfonyl-amino]propanoate

Systemtic Name: 3-[ethyl-(4-fluoranyl-2-methyl-phenyl)sulfonyl-amino]propanoate Openeye Name: 3-[ethyl-(4-fluoro-2-methyl-phenyl)sulfonyl-amino]propanoate CAS Name: 3-[ethyl-(4-fluoro-2-methylphenyl)sulfonylamino]propanoate IUPAC Name: 3-[ethyl-(4-fluoro-2-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-[ethyl-(4-fluoro-2-methyl-phenyl)sulfonyl-amino]propionate Formula: C12H15FNO4S- MolecularWeight: 288.315203

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)[O-])S(=O)(=O)C1=C(C=C(C=C1)F)C

Isomeric SMILES

CCN(CCC(=O)[O-])S(=O)(=O)C1=C(C=C(C=C1)F)C

InChI

InChI=1S/C12H16FNO4S/c1-3-14(7-6-12(15)16)19(17,18)11-5-4-10(13)8-9(11)2/h4-5,8H,3,6-7H2,1-2H3,(H,15,16)/p-1