(E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(2,5-dimethylphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(2,5-dimethylphenyl)acrylic acid Formula: C12H11NO2 MolecularWeight: 201.22124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=C(C#N)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C12H11NO2/c1-8-3-4-9(2)10(5-8)6-11(7-13)12(14)15/h3-6H,1-2H3,(H,14,15)/b11-6+