dimethyl 3,4-dihydroisochromene-1,1-dicarboxylate

Systemtic Name: dimethyl 3,4-dihydroisochromene-1,1-dicarboxylate Openeye Name: dimethyl isochromane-1,1-dicarboxylate CAS Name: 3,4-dihydro-1H-2-benzopyran-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3,4-dihydroisochromene-1,1-dicarboxylate Traditional Name: isochroman-1,1-dicarboxylic acid dimethyl ester Formula: C13H14O5 MolecularWeight: 250.24726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C2=CC=CC=C2CCO1)C(=O)OC

Isomeric SMILES

COC(=O)C1(C2=CC=CC=C2CCO1)C(=O)OC

InChI

InChI=1S/C13H14O5/c1-16-11(14)13(12(15)17-2)10-6-4-3-5-9(10)7-8-18-13/h3-6H,7-8H2,1-2H3