(E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(4-methoxycarbonylphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-carbomethoxyphenyl)-2-cyano-acrylic acid Formula: C12H9NO4 MolecularWeight: 231.20416

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C12H9NO4/c1-17-12(16)9-4-2-8(3-5-9)6-10(7-13)11(14)15/h2-6H,1H3,(H,14,15)/b10-6+