[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C13H10ClFN2O3 MolecularWeight: 296.681503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=C(C=CC=C1Cl)F)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=C(C=CC=C1Cl)F)/N

InChI

InChI=1S/C13H10ClFN2O3/c1-7(17)8(5-16)11(18)6-20-13(19)12-9(14)3-2-4-10(12)15/h2-4H,6,17H2,1H3/b8-7+