2-[(E)-4-(4-chlorophenyl)but-3-en-2-ylidene]propanedioic acid

Systemtic Name: 2-[(E)-4-(4-chlorophenyl)but-3-en-2-ylidene]propanedioic acid Openeye Name: 2-[(E)-3-(4-chlorophenyl)-1-methyl-prop-2-enylidene]propanedioic acid CAS Name: 2-[(E)-4-(4-chlorophenyl)but-3-en-2-ylidene]propanedioic acid IUPAC Name: 2-[(E)-4-(4-chlorophenyl)but-3-en-2-ylidene]propanedioic acid Traditional Name: 2-[(E)-3-(4-chlorophenyl)-1-methyl-prop-2-enylidene]malonic acid Formula: C13H11ClO4 MolecularWeight: 266.67704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClO4/c1-8(11(12(15)16)13(17)18)2-3-9-4-6-10(14)7-5-9/h2-7H,1H3,(H,15,16)(H,17,18)/b3-2+