3-methyl-5-(6-methylheptan-2-yl)-8-methylidene-7-oxidanyl-1,3a,5,6,7,8a-hexahydroazulen-4-one

Systemtic Name: 3-methyl-5-(6-methylheptan-2-yl)-8-methylidene-7-oxidanyl-1,3a,5,6,7,8a-hexahydroazulen-4-one Openeye Name: 5-(1,5-dimethylhexyl)-7-hydroxy-3-methyl-8-methylene-1,3a,5,6,7,8a-hexahydroazulen-4-one CAS Name: 7-hydroxy-3-methyl-8-methylene-5-(6-methylheptan-2-yl)-1,3a,5,6,7,8a-hexahydroazulen-4-one IUPAC Name: 7-hydroxy-3-methyl-5-(6-methylheptan-2-yl)-8-methylidene-1,3a,5,6,7,8a-hexahydroazulen-4-one Traditional Name: 5-(1,5-dimethylhexyl)-7-hydroxy-3-methyl-8-methylene-1,3a,5,6,7,8a-hexahydroazulen-4-one Formula: C20H32O2 MolecularWeight: 304.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C1C(=O)C(CC(C2=C)O)C(C)CCCC(C)C

Isomeric SMILES

CC1=CCC2C1C(=O)C(CC(C2=C)O)C(C)CCCC(C)C

InChI

InChI=1S/C20H32O2/c1-12(2)7-6-8-13(3)17-11-18(21)15(5)16-10-9-14(4)19(16)20(17)22/h9,12-13,16-19,21H,5-8,10-11H2,1-4H3