(2E,4E)-5-phenylpenta-2,4-dienoic acid; prop-2-enenitrile

Systemtic Name: (2E,4E)-5-phenylpenta-2,4-dienoic acid; prop-2-enenitrile Openeye Name: (2E,4E)-5-phenylpenta-2,4-dienoic acid; prop-2-enenitrile CAS Name: (2E,4E)-5-phenylpenta-2,4-dienoic acid; 2-propenenitrile IUPAC Name: (2E,4E)-5-phenylpenta-2,4-dienoic acid; prop-2-enenitrile Traditional Name: acrylonitrile; (2E,4E)-5-phenylpenta-2,4-dienoic acid Formula: C14H13NO2 MolecularWeight: 227.25852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10O2.C3H3N/c12-11(13)9-5-4-8-10-6-2-1-3-7-10;1-2-3-4/h1-9H,(H,12,13);2H,1H2/b8-4+,9-5+;