dimethyl 3-(chloromethyl)-6-oxidanyl-cyclohexa-1,4-diene-1,3-dicarboxylate

Systemtic Name: dimethyl 3-(chloromethyl)-6-oxidanyl-cyclohexa-1,4-diene-1,3-dicarboxylate Openeye Name: dimethyl 3-(chloromethyl)-6-hydroxy-cyclohexa-1,4-diene-1,3-dicarboxylate CAS Name: 3-(chloromethyl)-6-hydroxycyclohexa-1,4-diene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(chloromethyl)-6-hydroxycyclohexa-1,4-diene-1,3-dicarboxylate Traditional Name: 3-(chloromethyl)-6-hydroxy-cyclohexa-1,4-diene-1,3-dicarboxylic acid dimethyl ester Formula: C11H13ClO5 MolecularWeight: 260.67092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(C=CC1O)(CCl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(C=CC1O)(CCl)C(=O)OC

InChI

InChI=1S/C11H13ClO5/c1-16-9(14)7-5-11(6-12,10(15)17-2)4-3-8(7)13/h3-5,8,13H,6H2,1-2H3