4,7,8-trimethyl-1-[(6Z)-2-methyl-3-oxidanyl-6-(2-oxidanylethylidene)oxepan-2-yl]nonan-5-one

Systemtic Name: 4,7,8-trimethyl-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]-4,7,8-trimethyl-nonan-5-one CAS Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyl-2-oxepanyl]-4,7,8-trimethyl-5-nonanone IUPAC Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-4,7,8-trimethylnonan-5-one Traditional Name: 1-[(6Z)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyl-oxepan-2-yl]-4,7,8-trimethyl-nonan-5-one Formula: C21H38O4 MolecularWeight: 354.52402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H38O4/c1-15(2)17(4)13-19(23)16(3)7-6-11-21(5)20(24)9-8-18(10-12-22)14-25-21/h10,15-17,20,22,24H,6-9,11-14H2,1-5H3/b18-10-