2-[(E)-3-(4-bromophenyl)-2-methyl-prop-2-enylidene]propanedioic acid

Systemtic Name: 2-[(E)-3-(4-bromophenyl)-2-methyl-prop-2-enylidene]propanedioic acid Openeye Name: 2-[(E)-3-(4-bromophenyl)-2-methyl-prop-2-enylidene]propanedioic acid CAS Name: 2-[(E)-3-(4-bromophenyl)-2-methylprop-2-enylidene]propanedioic acid IUPAC Name: 2-[(E)-3-(4-bromophenyl)-2-methylprop-2-enylidene]propanedioic acid Traditional Name: 2-[(E)-3-(4-bromophenyl)-2-methyl-prop-2-enylidene]malonic acid Formula: C13H11BrO4 MolecularWeight: 311.12804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)Br)/C=C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H11BrO4/c1-8(7-11(12(15)16)13(17)18)6-9-2-4-10(14)5-3-9/h2-7H,1H3,(H,15,16)(H,17,18)/b8-6+