2-[1-(4-bromophenyl)-3-cyclopropyl-3-oxidanylidene-propyl]propanedioic acid

Systemtic Name: 2-[1-(4-bromophenyl)-3-cyclopropyl-3-oxidanylidene-propyl]propanedioic acid Openeye Name: 2-[1-(4-bromophenyl)-3-cyclopropyl-3-oxo-propyl]propanedioic acid CAS Name: 2-[1-(4-bromophenyl)-3-cyclopropyl-3-oxopropyl]propanedioic acid IUPAC Name: 2-[1-(4-bromophenyl)-3-cyclopropyl-3-oxopropyl]propanedioic acid Traditional Name: 2-[1-(4-bromophenyl)-3-cyclopropyl-3-keto-propyl]malonic acid Formula: C15H15BrO5 MolecularWeight: 355.1806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)CC(C2=CC=C(C=C2)Br)C(C(=O)O)C(=O)O

Isomeric SMILES

C1CC1C(=O)CC(C2=CC=C(C=C2)Br)C(C(=O)O)C(=O)O

InChI

InChI=1S/C15H15BrO5/c16-10-5-3-8(4-6-10)11(7-12(17)9-1-2-9)13(14(18)19)15(20)21/h3-6,9,11,13H,1-2,7H2,(H,18,19)(H,20,21)