(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[[2,6-bis(fluoranyl)phenyl]sulfonylamino]ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[[2,6-bis(fluoranyl)phenyl]sulfonylamino]ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[(2,6-difluorophenyl)sulfonylamino]acetate CAS Name: 2-[(2,6-difluorophenyl)sulfonylamino]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-[(2,6-difluorophenyl)sulfonylamino]acetate Traditional Name: 2-[(2,6-difluorophenyl)sulfonylamino]acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C14H13F2N3O5S MolecularWeight: 373.331926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CNS(=O)(=O)C1=C(C=CC=C1F)F

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CNS(=O)(=O)C1=C(C=CC=C1F)F

InChI

InChI=1S/C14H13F2N3O5S/c1-8(18)9(5-17)12(20)7-24-13(21)6-19-25(22,23)14-10(15)3-2-4-11(14)16/h2-4,9,18-19H,6-7H2,1H3