(4-oxidanylidenecyclohexa-1,5-dien-1-yl) benzoate

Systemtic Name: (4-oxidanylidenecyclohexa-1,5-dien-1-yl) benzoate Openeye Name: (4-oxocyclohexa-1,5-dien-1-yl) benzoate CAS Name: benzoic acid (4-oxo-1-cyclohexa-1,5-dienyl) ester IUPAC Name: (4-oxocyclohexa-1,5-dien-1-yl) benzoate Traditional Name: benzoic acid (4-ketocyclohexa-1,5-dien-1-yl) ester Formula: C13H10O3 MolecularWeight: 214.2167

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1=O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C1C=C(C=CC1=O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H10O3/c14-11-6-8-12(9-7-11)16-13(15)10-4-2-1-3-5-10/h1-6,8-9H,7H2