6-oxidanylidene-1-(phenylmethyl)cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-oxidanylidene-1-(phenylmethyl)cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 1-benzyl-6-oxo-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-oxo-1-(phenylmethyl)-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 1-benzyl-6-oxocyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 1-benzyl-6-keto-cyclohexa-2,4-diene-1-carboxylic acid Formula: C14H12O3 MolecularWeight: 228.24328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2(C=CC=CC2=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2(C=CC=CC2=O)C(=O)O

InChI

InChI=1S/C14H12O3/c15-12-8-4-5-9-14(12,13(16)17)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)