(E)-5-(2-cyanophenyl)-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: (E)-5-(2-cyanophenyl)-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-5-(2-cyanophenyl)-3-oxo-pent-4-enoic acid CAS Name: (E)-5-(2-cyanophenyl)-3-oxo-4-pentenoic acid IUPAC Name: (E)-5-(2-cyanophenyl)-3-oxopent-4-enoic acid Traditional Name: (E)-5-(2-cyanophenyl)-3-keto-pent-4-enoic acid Formula: C12H9NO3 MolecularWeight: 215.20476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO3/c13-8-10-4-2-1-3-9(10)5-6-11(14)7-12(15)16/h1-6H,7H2,(H,15,16)/b6-5+