dimethyl 4-(2-oxidanylidenepropyl)benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4-(2-oxidanylidenepropyl)benzene-1,2-dicarboxylate Openeye Name: dimethyl 4-acetonylbenzene-1,2-dicarboxylate CAS Name: 4-(2-oxopropyl)benzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(2-oxopropyl)benzene-1,2-dicarboxylate Traditional Name: 4-acetonylbenzene-1,2-dicarboxylic acid dimethyl ester Formula: C13H14O5 MolecularWeight: 250.24726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O5/c1-8(14)6-9-4-5-10(12(15)17-2)11(7-9)13(16)18-3/h4-5,7H,6H2,1-3H3