(2E)-2-[(2-chloranyl-3-cyano-phenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: (2E)-2-[(2-chloranyl-3-cyano-phenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: (2E)-2-[(2-chloro-3-cyano-phenyl)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(2-chloro-3-cyanophenyl)methylidene]-3-oxobutanoate IUPAC Name: (2E)-2-[(2-chloro-3-cyanophenyl)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(2-chloro-3-cyano-phenyl)acrylate Formula: C12H7ClNO3- MolecularWeight: 248.64188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC(=C1Cl)C#N)C(=O)[O-]

Isomeric SMILES

CC(=O)/C(=C\C1=CC=CC(=C1Cl)C#N)/C(=O)[O-]

InChI

InChI=1S/C12H8ClNO3/c1-7(15)10(12(16)17)5-8-3-2-4-9(6-14)11(8)13/h2-5H,1H3,(H,16,17)/p-1/b10-5+