(2E,4E)-5-phenylpenta-2,4-dienenitrile; prop-2-enoic acid

Systemtic Name: (2E,4E)-5-phenylpenta-2,4-dienenitrile; prop-2-enoic acid Openeye Name: acrylic acid; (2E,4E)-5-phenylpenta-2,4-dienenitrile CAS Name: (2E,4E)-5-phenylpenta-2,4-dienenitrile; 2-propenoic acid IUPAC Name: (2E,4E)-5-phenylpenta-2,4-dienenitrile; prop-2-enoic acid Traditional Name: acrylic acid; (2E,4E)-5-phenylpenta-2,4-dienenitrile Formula: C14H13NO2 MolecularWeight: 227.25852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C=CC(=O)O.C1=CC=C(C=C1)/C=C/C=C/C#N

InChI

InChI=1S/C11H9N.C3H4O2/c12-10-6-2-5-9-11-7-3-1-4-8-11;1-2-3(4)5/h1-9H;2H,1H2,(H,4,5)/b6-2+,9-5+;