methyl 1-ethanoyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: methyl 1-ethanoyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate Openeye Name: methyl 1-acetyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate CAS Name: 1-acetyl-4-phenyl-1-cyclohexa-2,5-dienecarboxylic acid methyl ester IUPAC Name: methyl 1-acetyl-4-phenylcyclohexa-2,5-diene-1-carboxylate Traditional Name: 1-acetyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid methyl ester Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C=CC(C=C1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(=O)C1(C=CC(C=C1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H16O3/c1-12(17)16(15(18)19-2)10-8-14(9-11-16)13-6-4-3-5-7-13/h3-11,14H,1-2H3