(E)-6-(2-cyanophenyl)-3-oxidanylidene-hex-5-enoic acid

Systemtic Name: (E)-6-(2-cyanophenyl)-3-oxidanylidene-hex-5-enoic acid Openeye Name: (E)-6-(2-cyanophenyl)-3-oxo-hex-5-enoic acid CAS Name: (E)-6-(2-cyanophenyl)-3-oxo-5-hexenoic acid IUPAC Name: (E)-6-(2-cyanophenyl)-3-oxohex-5-enoic acid Traditional Name: (E)-6-(2-cyanophenyl)-3-keto-hex-5-enoic acid Formula: C13H11NO3 MolecularWeight: 229.23134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO3/c14-9-11-5-2-1-4-10(11)6-3-7-12(15)8-13(16)17/h1-6H,7-8H2,(H,16,17)/b6-3+