2-methoxy-4-methyl-3-(6-methyl-3-oxidanyl-heptan-2-yl)-4-oxidanyl-cyclohexan-1-one

Systemtic Name: 2-methoxy-4-methyl-3-(6-methyl-3-oxidanyl-heptan-2-yl)-4-oxidanyl-cyclohexan-1-one Openeye Name: 4-hydroxy-3-(2-hydroxy-1,5-dimethyl-hexyl)-2-methoxy-4-methyl-cyclohexanone CAS Name: 4-hydroxy-3-(3-hydroxy-6-methylheptan-2-yl)-2-methoxy-4-methyl-1-cyclohexanone IUPAC Name: 4-hydroxy-3-(3-hydroxy-6-methylheptan-2-yl)-2-methoxy-4-methylcyclohexan-1-one Traditional Name: 4-hydroxy-3-(2-hydroxy-1,5-dimethyl-hexyl)-2-methoxy-4-methyl-cyclohexanone Formula: C16H30O4 MolecularWeight: 286.407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(C)C1C(C(=O)CCC1(C)O)OC)O

Isomeric SMILES

CC(C)CCC(C(C)C1C(C(=O)CCC1(C)O)OC)O

InChI

InChI=1S/C16H30O4/c1-10(2)6-7-12(17)11(3)14-15(20-5)13(18)8-9-16(14,4)19/h10-12,14-15,17,19H,6-9H2,1-5H3