methyl (E)-3-azanyl-2-cyano-3-iodanyl-prop-2-enoate

Systemtic Name: methyl (E)-3-azanyl-2-cyano-3-iodanyl-prop-2-enoate Openeye Name: methyl (E)-3-amino-2-cyano-3-iodo-prop-2-enoate CAS Name: (E)-3-amino-2-cyano-3-iodo-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-amino-2-cyano-3-iodoprop-2-enoate Traditional Name: (E)-3-amino-2-cyano-3-iodo-acrylic acid methyl ester Formula: C5H5IN2O2 MolecularWeight: 252.00987

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)/C(=C(\N)/I)/C#N

InChI

InChI=1S/C5H5IN2O2/c1-10-5(9)3(2-7)4(6)8/h8H2,1H3/b4-3-