2-bromanyl-5-methyl-6-oxidanyl-3-(phenylmethyl)benzoic acid

Systemtic Name: 2-bromanyl-5-methyl-6-oxidanyl-3-(phenylmethyl)benzoic acid Openeye Name: 3-benzyl-2-bromo-6-hydroxy-5-methyl-benzoic acid CAS Name: 2-bromo-6-hydroxy-5-methyl-3-(phenylmethyl)benzoic acid IUPAC Name: 3-benzyl-2-bromo-6-hydroxy-5-methylbenzoic acid Traditional Name: 3-benzyl-2-bromo-6-hydroxy-5-methyl-benzoic acid Formula: C15H13BrO3 MolecularWeight: 321.16592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C(=O)O)Br)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C(=C1O)C(=O)O)Br)CC2=CC=CC=C2

InChI

InChI=1S/C15H13BrO3/c1-9-7-11(8-10-5-3-2-4-6-10)13(16)12(14(9)17)15(18)19/h2-7,17H,8H2,1H3,(H,18,19)