buta-1,3-diene; (2E,4E)-5-cyanopenta-2,4-dienoate

Systemtic Name: buta-1,3-diene; (2E,4E)-5-cyanopenta-2,4-dienoate Openeye Name: buta-1,3-diene; (2E,4E)-5-cyanopenta-2,4-dienoate CAS Name: buta-1,3-diene; (2E,4E)-5-cyanopenta-2,4-dienoate IUPAC Name: buta-1,3-diene; (2E,4E)-5-cyanopenta-2,4-dienoate Traditional Name: buta-1,3-diene; (2E,4E)-5-cyanopenta-2,4-dienoate Formula: C10H10NO2- MolecularWeight: 176.1919

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5NO2.C4H6/c7-5-3-1-2-4-6(8)9;1-3-4-2/h1-4H,(H,8,9);3-4H,1-2H2/p-1/b3-1+,4-2+;