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

Systemtic Name: (E)-2-cyano-3-(3-methylphenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(m-tolyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(3-methylphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(3-methylphenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(m-tolyl)acrylic acid Formula: C11H9NO2 MolecularWeight: 187.19466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO2/c1-8-3-2-4-9(5-8)6-10(7-12)11(13)14/h2-6H,1H3,(H,13,14)/b10-6+