dimethyl 2-(2-prop-1-en-2-yl-2,3,3a,4,5,6-hexahydropentalen-1-yl)propanedioate

Systemtic Name: dimethyl 2-(2-prop-1-en-2-yl-2,3,3a,4,5,6-hexahydropentalen-1-yl)propanedioate Openeye Name: dimethyl 2-(2-isopropenyl-2,3,3a,4,5,6-hexahydropentalen-1-yl)propanedioate CAS Name: 2-[2-(1-methylethenyl)-2,3,3a,4,5,6-hexahydropentalen-1-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-prop-1-en-2-yl-2,3,3a,4,5,6-hexahydropentalen-1-yl)propanedioate Traditional Name: 2-(2-isopropenyl-2,3,3a,4,5,6-hexahydropentalen-1-yl)malonic acid dimethyl ester Formula: C16H22O4 MolecularWeight: 278.34348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CC2CCCC2=C1C(C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=C)C1CC2CCCC2=C1C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H22O4/c1-9(2)12-8-10-6-5-7-11(10)13(12)14(15(17)19-3)16(18)20-4/h10,12,14H,1,5-8H2,2-4H3