methyl (E)-2-cyano-3-(1H-imidazol-5-yl)prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-(1H-imidazol-5-yl)prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-(1H-imidazol-5-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-(1H-imidazol-5-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(1H-imidazol-5-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(1H-imidazol-5-yl)acrylic acid methyl ester Formula: C8H7N3O2 MolecularWeight: 177.16008

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CN=CN1)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CN=CN1)/C#N

InChI

InChI=1S/C8H7N3O2/c1-13-8(12)6(3-9)2-7-4-10-5-11-7/h2,4-5H,1H3,(H,10,11)/b6-2+