dimethyl 2-(4-methylcyclohexa-1,3-dien-1-yl)propanedioate

Systemtic Name: dimethyl 2-(4-methylcyclohexa-1,3-dien-1-yl)propanedioate Openeye Name: dimethyl 2-(4-methylcyclohexa-1,3-dien-1-yl)propanedioate CAS Name: 2-(4-methyl-1-cyclohexa-1,3-dienyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(4-methylcyclohexa-1,3-dien-1-yl)propanedioate Traditional Name: 2-(4-methylcyclohexa-1,3-dien-1-yl)malonic acid dimethyl ester Formula: C12H16O4 MolecularWeight: 224.25304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O4/c1-8-4-6-9(7-5-8)10(11(13)15-2)12(14)16-3/h4,6,10H,5,7H2,1-3H3