(E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoic acid Traditional Name: (E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid Formula: C13H10N2O4 MolecularWeight: 258.2295

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)O)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)O)OCC#N

InChI

InChI=1S/C13H10N2O4/c1-18-12-7-9(6-10(8-15)13(16)17)2-3-11(12)19-5-4-14/h2-3,6-7H,5H2,1H3,(H,16,17)/b10-6+