5-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]cyclohexane-1,3-diol

Systemtic Name: 5-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]cyclohexane-1,3-diol Openeye Name: 5-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]cyclohexane-1,3-diol CAS Name: 5-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]cyclohexane-1,3-diol IUPAC Name: 5-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]cyclohexane-1,3-diol Traditional Name: 5-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]cyclohexane-1,3-diol Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CC(C2)O)O)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CC(C2)O)O)O

InChI

InChI=1S/C21H34O3/c1-4-5-6-7-10-21(2,3)16-8-9-19(20(24)13-16)15-11-17(22)14-18(23)12-15/h8-9,13,15,17-18,22-24H,4-7,10-12,14H2,1-3H3