methyl (E)-3-chloranyl-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-chloranyl-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-chloro-2-cyano-prop-2-enoate CAS Name: (E)-3-chloro-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-chloro-2-cyanoprop-2-enoate Traditional Name: (E)-3-chloro-2-cyano-acrylic acid methyl ester Formula: C5H4ClNO2 MolecularWeight: 145.54376

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CCl)C#N

Isomeric SMILES

COC(=O)/C(=C/Cl)/C#N

InChI

InChI=1S/C5H4ClNO2/c1-9-5(8)4(2-6)3-7/h2H,1H3/b4-2+