(3S,5R,6R)-3,5-dimethyl-6-[(E)-6-methyl-7-oxidanylidene-oct-2-en-2-yl]oxan-2-one

Systemtic Name: (3S,5R,6R)-3,5-dimethyl-6-[(E)-6-methyl-7-oxidanylidene-oct-2-en-2-yl]oxan-2-one Openeye Name: (3S,5R,6R)-6-[(E)-1,5-dimethyl-6-oxo-hept-1-enyl]-3,5-dimethyl-tetrahydropyran-2-one CAS Name: (3S,5R,6R)-3,5-dimethyl-6-[(E)-6-methyl-7-oxooct-2-en-2-yl]-2-oxanone IUPAC Name: (3S,5R,6R)-3,5-dimethyl-6-[(E)-6-methyl-7-oxooct-2-en-2-yl]oxan-2-one Traditional Name: (3S,5R,6R)-6-[(E)-6-keto-1,5-dimethyl-hept-1-enyl]-3,5-dimethyl-tetrahydropyran-2-one Formula: C16H26O3 MolecularWeight: 266.37584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)OC1C(=CCCC(C)C(=O)C)C)C

Isomeric SMILES

C[C@@H]1C[C@@H](C(=O)O[C@H]1/C(=C/CCC(C)C(=O)C)/C)C

InChI

InChI=1S/C16H26O3/c1-10(14(5)17)7-6-8-11(2)15-12(3)9-13(4)16(18)19-15/h8,10,12-13,15H,6-7,9H2,1-5H3/b11-8+/t10?,12-,13+,15+/m1/s1