2-[(2-bromophenyl)-phenyl-methyl]propanedioic acid

Systemtic Name: 2-[(2-bromophenyl)-phenyl-methyl]propanedioic acid Openeye Name: 2-[(2-bromophenyl)-phenyl-methyl]propanedioic acid CAS Name: 2-[(2-bromophenyl)-phenylmethyl]propanedioic acid IUPAC Name: 2-[(2-bromophenyl)-phenylmethyl]propanedioic acid Traditional Name: 2-[(2-bromophenyl)-phenyl-methyl]malonic acid Formula: C16H13BrO4 MolecularWeight: 349.17602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2Br)C(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2Br)C(C(=O)O)C(=O)O

InChI

InChI=1S/C16H13BrO4/c17-12-9-5-4-8-11(12)13(10-6-2-1-3-7-10)14(15(18)19)16(20)21/h1-9,13-14H,(H,18,19)(H,20,21)