dimethyl 2-cyclohepta-2,4,6-trien-1-yl-2-oxidanyl-propanedioate

Systemtic Name: dimethyl 2-cyclohepta-2,4,6-trien-1-yl-2-oxidanyl-propanedioate Openeye Name: dimethyl 2-cyclohepta-2,4,6-trien-1-yl-2-hydroxy-propanedioate CAS Name: 2-(1-cyclohepta-2,4,6-trienyl)-2-hydroxypropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-cyclohepta-2,4,6-trien-1-yl-2-hydroxypropanedioate Traditional Name: 2-cyclohepta-2,4,6-trien-1-yl-2-hydroxy-malonic acid dimethyl ester Formula: C12H14O5 MolecularWeight: 238.23656

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1C=CC=CC=C1)(C(=O)OC)O

Isomeric SMILES

COC(=O)C(C1C=CC=CC=C1)(C(=O)OC)O

InChI

InChI=1S/C12H14O5/c1-16-10(13)12(15,11(14)17-2)9-7-5-3-4-6-8-9/h3-9,15H,1-2H3