dimethyl 2-cyclohepta-2,4-dien-1-ylpropanedioate

Systemtic Name: dimethyl 2-cyclohepta-2,4-dien-1-ylpropanedioate Openeye Name: dimethyl 2-cyclohepta-2,4-dien-1-ylpropanedioate CAS Name: 2-(1-cyclohepta-2,4-dienyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-cyclohepta-2,4-dien-1-ylpropanedioate Traditional Name: 2-cyclohepta-2,4-dien-1-ylmalonic acid dimethyl ester Formula: C12H16O4 MolecularWeight: 224.25304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C(C1CCC=CC=C1)C(=O)OC

InChI

InChI=1S/C12H16O4/c1-15-11(13)10(12(14)16-2)9-7-5-3-4-6-8-9/h3-5,7,9-10H,6,8H2,1-2H3