7-(3-bromanyl-4-methyl-phenyl)-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-(3-bromanyl-4-methyl-phenyl)-7-oxidanylidene-heptanoic acid Openeye Name: 7-(3-bromo-4-methyl-phenyl)-7-oxo-heptanoic acid CAS Name: 7-(3-bromo-4-methylphenyl)-7-oxoheptanoic acid IUPAC Name: 7-(3-bromo-4-methylphenyl)-7-oxoheptanoic acid Traditional Name: 7-(3-bromo-4-methyl-phenyl)-7-keto-enanthic acid Formula: C14H17BrO3 MolecularWeight: 313.18698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrO3/c1-10-7-8-11(9-12(10)15)13(16)5-3-2-4-6-14(17)18/h7-9H,2-6H2,1H3,(H,17,18)