(2E,4E)-hepta-2,4,6-trienenitrile; (E)-2-methylidene-5-phenyl-pent-4-enoate

Systemtic Name: (2E,4E)-hepta-2,4,6-trienenitrile; (E)-2-methylidene-5-phenyl-pent-4-enoate Openeye Name: (2E,4E)-hepta-2,4,6-trienenitrile; (E)-2-methylene-5-phenyl-pent-4-enoate CAS Name: (2E,4E)-hepta-2,4,6-trienenitrile; (E)-2-methylene-5-phenyl-4-pentenoate IUPAC Name: (2E,4E)-hepta-2,4,6-trienenitrile; (E)-2-methylidene-5-phenylpent-4-enoate Traditional Name: (2E,4E)-hepta-2,4,6-trienenitrile; (E)-2-methylene-5-phenyl-pent-4-enoate Formula: C19H18NO2- MolecularWeight: 292.35172

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CC=CC#N.C=C(CC=CC1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

C=C/C=C/C=C/C#N.C=C(C/C=C/C1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C12H12O2.C7H7N/c1-10(12(13)14)6-5-9-11-7-3-2-4-8-11;1-2-3-4-5-6-7-8/h2-5,7-9H,1,6H2,(H,13,14);2-6H,1H2/p-1/b9-5+;4-3+,6-5+