6-[3-(5,5-dimethyl-6-oxidanylidene-7-phenyl-heptoxy)propoxy]-2,2-dimethyl-hexanoic acid

Systemtic Name: 6-[3-(5,5-dimethyl-6-oxidanylidene-7-phenyl-heptoxy)propoxy]-2,2-dimethyl-hexanoic acid Openeye Name: 6-[3-(5,5-dimethyl-6-oxo-7-phenyl-heptoxy)propoxy]-2,2-dimethyl-hexanoic acid CAS Name: 6-[3-(5,5-dimethyl-6-oxo-7-phenylheptoxy)propoxy]-2,2-dimethylhexanoic acid IUPAC Name: 6-[3-(5,5-dimethyl-6-oxo-7-phenylheptoxy)propoxy]-2,2-dimethylhexanoic acid Traditional Name: 6-[3-(6-keto-5,5-dimethyl-7-phenyl-heptoxy)propoxy]-2,2-dimethyl-hexanoic acid Formula: C26H42O5 MolecularWeight: 434.60868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H42O5/c1-25(2,23(27)21-22-13-6-5-7-14-22)15-8-10-17-30-19-12-20-31-18-11-9-16-26(3,4)24(28)29/h5-7,13-14H,8-12,15-21H2,1-4H3,(H,28,29)