2-[5-butyl-2-(2,3-dimethyl-4-oxidanyl-butan-2-yl)cyclohexen-1-yl]-5-heptan-2-yl-benzene-1,3-diol

Systemtic Name: 2-[5-butyl-2-(2,3-dimethyl-4-oxidanyl-butan-2-yl)cyclohexen-1-yl]-5-heptan-2-yl-benzene-1,3-diol Openeye Name: 2-[5-butyl-2-(3-hydroxy-1,1,2-trimethyl-propyl)cyclohexen-1-yl]-5-(1-methylhexyl)benzene-1,3-diol CAS Name: 2-[5-butyl-2-(4-hydroxy-2,3-dimethylbutan-2-yl)-1-cyclohexenyl]-5-heptan-2-ylbenzene-1,3-diol IUPAC Name: 2-[5-butyl-2-(4-hydroxy-2,3-dimethylbutan-2-yl)cyclohexen-1-yl]-5-heptan-2-ylbenzene-1,3-diol Traditional Name: 2-[5-butyl-2-(3-hydroxy-1,1,2-trimethyl-propyl)cyclohexen-1-yl]-5-(1-methylhexyl)resorcinol Formula: C29H48O3 MolecularWeight: 444.68962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1=CC(=C(C(=C1)O)C2=C(CCC(C2)CCCC)C(C)(C)C(C)CO)O

Isomeric SMILES

CCCCCC(C)C1=CC(=C(C(=C1)O)C2=C(CCC(C2)CCCC)C(C)(C)C(C)CO)O

InChI

InChI=1S/C29H48O3/c1-7-9-11-12-20(3)23-17-26(31)28(27(32)18-23)24-16-22(13-10-8-2)14-15-25(24)29(5,6)21(4)19-30/h17-18,20-22,30-32H,7-16,19H2,1-6H3