(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]propanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]propanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 3-[(3-chloro-4-fluoro-phenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chloro-4-fluorophenyl)sulfonylamino]propanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 3-[(3-chloro-4-fluorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chloro-4-fluoro-phenyl)sulfonylamino]propionic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C15H15ClFN3O5S MolecularWeight: 403.813103

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CCNS(=O)(=O)C1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CCNS(=O)(=O)C1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C15H15ClFN3O5S/c1-9(19)11(7-18)14(21)8-25-15(22)4-5-20-26(23,24)10-2-3-13(17)12(16)6-10/h2-3,6,11,19-20H,4-5,8H2,1H3