(phenylmethyl) 3,5-dimethylcyclohexa-1,5-diene-1-carboxylate

Systemtic Name: (phenylmethyl) 3,5-dimethylcyclohexa-1,5-diene-1-carboxylate Openeye Name: benzyl 3,5-dimethylcyclohexa-1,5-diene-1-carboxylate CAS Name: 3,5-dimethyl-1-cyclohexa-1,5-dienecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3,5-dimethylcyclohexa-1,5-diene-1-carboxylate Traditional Name: 3,5-dimethylcyclohexa-1,5-diene-1-carboxylic acid benzyl ester Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=C1)C(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1CC(=CC(=C1)C(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C16H18O2/c1-12-8-13(2)10-15(9-12)16(17)18-11-14-6-4-3-5-7-14/h3-7,9-10,12H,8,11H2,1-2H3