6-(3-bromanyl-4-methyl-phenyl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(3-bromanyl-4-methyl-phenyl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(3-bromo-4-methyl-phenyl)-6-oxo-hexanoic acid CAS Name: 6-(3-bromo-4-methylphenyl)-6-oxohexanoic acid IUPAC Name: 6-(3-bromo-4-methylphenyl)-6-oxohexanoic acid Traditional Name: 6-(3-bromo-4-methyl-phenyl)-6-keto-hexanoic acid Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrO3/c1-9-6-7-10(8-11(9)14)12(15)4-2-3-5-13(16)17/h6-8H,2-5H2,1H3,(H,16,17)