methyl (E)-3-azanyl-2-[2-chloranyl-4,5-bis(fluoranyl)phenyl]carbonyl-prop-2-enoate

Systemtic Name: methyl (E)-3-azanyl-2-[2-chloranyl-4,5-bis(fluoranyl)phenyl]carbonyl-prop-2-enoate Openeye Name: methyl (E)-3-amino-2-(2-chloro-4,5-difluoro-benzoyl)prop-2-enoate CAS Name: (E)-3-amino-2-[(2-chloro-4,5-difluorophenyl)-oxomethyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-amino-2-(2-chloro-4,5-difluorobenzoyl)prop-2-enoate Traditional Name: (E)-3-amino-2-(2-chloro-4,5-difluoro-benzoyl)acrylic acid methyl ester Formula: C11H8ClF2NO3 MolecularWeight: 275.635926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CN)C(=O)C1=CC(=C(C=C1Cl)F)F

Isomeric SMILES

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

InChI

InChI=1S/C11H8ClF2NO3/c1-18-11(17)6(4-15)10(16)5-2-8(13)9(14)3-7(5)12/h2-4H,15H2,1H3/b6-4+