dimethyl (E)-2-(3,4-dichlorophenyl)carbonylbut-2-enedioate

Systemtic Name: dimethyl (E)-2-(3,4-dichlorophenyl)carbonylbut-2-enedioate Openeye Name: dimethyl (E)-2-(3,4-dichlorobenzoyl)but-2-enedioate CAS Name: (E)-2-[(3,4-dichlorophenyl)-oxomethyl]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(3,4-dichlorobenzoyl)but-2-enedioate Traditional Name: (E)-2-(3,4-dichlorobenzoyl)but-2-enedioic acid dimethyl ester Formula: C13H10Cl2O5 MolecularWeight: 317.1215

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)/C=C(\C(=O)C1=CC(=C(C=C1)Cl)Cl)/C(=O)OC

InChI

InChI=1S/C13H10Cl2O5/c1-19-11(16)6-8(13(18)20-2)12(17)7-3-4-9(14)10(15)5-7/h3-6H,1-2H3/b8-6+