2-[(4-bromophenyl)methyl]-2,3-dimethyl-butanedioic acid

Systemtic Name: 2-[(4-bromophenyl)methyl]-2,3-dimethyl-butanedioic acid Openeye Name: 2-[(4-bromophenyl)methyl]-2,3-dimethyl-butanedioic acid CAS Name: 2-[(4-bromophenyl)methyl]-2,3-dimethylbutanedioic acid IUPAC Name: 2-[(4-bromophenyl)methyl]-2,3-dimethylbutanedioic acid Traditional Name: 2-(4-bromobenzyl)-2,3-dimethyl-succinic acid Formula: C13H15BrO4 MolecularWeight: 315.1598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrO4/c1-8(11(15)16)13(2,12(17)18)7-9-3-5-10(14)6-4-9/h3-6,8H,7H2,1-2H3,(H,15,16)(H,17,18)