(E)-2-cyano-3-(2-methylphenyl)but-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(2-methylphenyl)but-2-enoic acid Openeye Name: (E)-2-cyano-3-(o-tolyl)but-2-enoic acid CAS Name: (E)-2-cyano-3-(2-methylphenyl)-2-butenoic acid IUPAC Name: (E)-2-cyano-3-(2-methylphenyl)but-2-enoic acid Traditional Name: (E)-2-cyano-3-(o-tolyl)but-2-enoic acid Formula: C12H11NO2 MolecularWeight: 201.22124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=C(C#N)C(=O)O)C

Isomeric SMILES

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

InChI

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