6-[4-(2-methylpropyl)phenyl]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[4-(2-methylpropyl)phenyl]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(4-isobutylphenyl)-6-oxo-hexanoic acid CAS Name: 6-[4-(2-methylpropyl)phenyl]-6-oxohexanoic acid IUPAC Name: 6-[4-(2-methylpropyl)phenyl]-6-oxohexanoic acid Traditional Name: 6-(4-isobutylphenyl)-6-keto-hexanoic acid Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3/c1-12(2)11-13-7-9-14(10-8-13)15(17)5-3-4-6-16(18)19/h7-10,12H,3-6,11H2,1-2H3,(H,18,19)