4,8-dimethyl-1-[(6Z)-2-methyl-3-oxidanyl-6-(2-oxidanylethylidene)oxepan-2-yl]nonan-5-one

Systemtic Name: 4,8-dimethyl-1-[(6Z)-2-methyl-3-oxidanyl-6-(2-oxidanylethylidene)oxepan-2-yl]nonan-5-one Openeye Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyl-oxepan-2-yl]-4,8-dimethyl-nonan-5-one CAS Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyl-2-oxepanyl]-4,8-dimethyl-5-nonanone IUPAC Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-4,8-dimethylnonan-5-one Traditional Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyl-oxepan-2-yl]-4,8-dimethyl-nonan-5-one Formula: C20H36O4 MolecularWeight: 340.49744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)C(C)CCCC1(C(CCC(=CCO)CO1)O)C

Isomeric SMILES

CC(C)CCC(=O)C(C)CCCC1(C(CC/C(=C/CO)/CO1)O)C

InChI

InChI=1S/C20H36O4/c1-15(2)7-9-18(22)16(3)6-5-12-20(4)19(23)10-8-17(11-13-21)14-24-20/h11,15-16,19,21,23H,5-10,12-14H2,1-4H3/b17-11-