methyl 6-(2-acetyloxyphenyl)-4,6-dimethyl-5-oxidanylidene-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: methyl 6-(2-acetyloxyphenyl)-4,6-dimethyl-5-oxidanylidene-cyclohexa-1,3-diene-1-carboxylate Openeye Name: methyl 6-(2-acetoxyphenyl)-4,6-dimethyl-5-oxo-cyclohexa-1,3-diene-1-carboxylate CAS Name: 6-(2-acetyloxyphenyl)-4,6-dimethyl-5-oxo-1-cyclohexa-1,3-dienecarboxylic acid methyl ester IUPAC Name: methyl 6-(2-acetyloxyphenyl)-4,6-dimethyl-5-oxocyclohexa-1,3-diene-1-carboxylate Traditional Name: 6-(2-acetoxyphenyl)-5-keto-4,6-dimethyl-cyclohexa-1,3-diene-1-carboxylic acid methyl ester Formula: C18H18O5 MolecularWeight: 314.33252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(C1=O)(C)C2=CC=CC=C2OC(=O)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C(C1=O)(C)C2=CC=CC=C2OC(=O)C)C(=O)OC

InChI

InChI=1S/C18H18O5/c1-11-9-10-14(17(21)22-4)18(3,16(11)20)13-7-5-6-8-15(13)23-12(2)19/h5-10H,1-4H3