bis(phenylmethyl) 2-[(E)-1,4-bis(chloranyl)but-3-en-2-ylidene]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[(E)-1,4-bis(chloranyl)but-3-en-2-ylidene]propanedioate Openeye Name: dibenzyl 2-[(E)-3-chloro-1-(chloromethyl)prop-2-enylidene]propanedioate CAS Name: 2-[(E)-1,4-dichlorobut-3-en-2-ylidene]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(E)-1,4-dichlorobut-3-en-2-ylidene]propanedioate Traditional Name: 2-[(E)-3-chloro-1-(chloromethyl)prop-2-enylidene]malonic acid dibenzyl ester Formula: C21H18Cl2O4 MolecularWeight: 405.27122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=C(CCl)C=CCl)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=C(CCl)/C=C/Cl)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H18Cl2O4/c22-12-11-18(13-23)19(20(24)26-14-16-7-3-1-4-8-16)21(25)27-15-17-9-5-2-6-10-17/h1-12H,13-15H2/b12-11+