2-[(4-bromophenyl)methyl]-2-methyl-butanedioic acid

Systemtic Name: 2-[(4-bromophenyl)methyl]-2-methyl-butanedioic acid Openeye Name: 2-[(4-bromophenyl)methyl]-2-methyl-butanedioic acid CAS Name: 2-[(4-bromophenyl)methyl]-2-methylbutanedioic acid IUPAC Name: 2-[(4-bromophenyl)methyl]-2-methylbutanedioic acid Traditional Name: 2-(4-bromobenzyl)-2-methyl-succinic acid Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrO4/c1-12(11(16)17,7-10(14)15)6-8-2-4-9(13)5-3-8/h2-5H,6-7H2,1H3,(H,14,15)(H,16,17)