diethyl 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]propanedioate

Systemtic Name: diethyl 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]propanedioate Openeye Name: diethyl 2-[(E)-3-(4-chlorophenyl)allyl]propanedioate CAS Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]propanedioate Traditional Name: 2-[(E)-3-(4-chlorophenyl)allyl]malonic acid diethyl ester Formula: C16H19ClO4 MolecularWeight: 310.77266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=CC1=CC=C(C=C1)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C/C=C/C1=CC=C(C=C1)Cl)C(=O)OCC

InChI

InChI=1S/C16H19ClO4/c1-3-20-15(18)14(16(19)21-4-2)7-5-6-12-8-10-13(17)11-9-12/h5-6,8-11,14H,3-4,7H2,1-2H3/b6-5+