ethyl 2-(4-methylphenyl)carbonylcyclohexa-1,3-diene-1-carboxylate

Systemtic Name: ethyl 2-(4-methylphenyl)carbonylcyclohexa-1,3-diene-1-carboxylate Openeye Name: ethyl 2-(4-methylbenzoyl)cyclohexa-1,3-diene-1-carboxylate CAS Name: 2-[(4-methylphenyl)-oxomethyl]-1-cyclohexa-1,3-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylbenzoyl)cyclohexa-1,3-diene-1-carboxylate Traditional Name: 2-p-toluoylcyclohexa-1,3-diene-1-carboxylic acid ethyl ester Formula: C17H18O3 MolecularWeight: 270.32302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CCC1)C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(C=CCC1)C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H18O3/c1-3-20-17(19)15-7-5-4-6-14(15)16(18)13-10-8-12(2)9-11-13/h4,6,8-11H,3,5,7H2,1-2H3