3,5-dimethyl-2-oxidanyl-6-[(E,4S,6R,8S)-4,6,8-trimethylundec-2-en-2-yl]pyran-4-one

Systemtic Name: 3,5-dimethyl-2-oxidanyl-6-[(E,4S,6R,8S)-4,6,8-trimethylundec-2-en-2-yl]pyran-4-one Openeye Name: 2-hydroxy-3,5-dimethyl-6-[(E,3S,5R,7S)-1,3,5,7-tetramethyldec-1-enyl]pyran-4-one CAS Name: 2-hydroxy-3,5-dimethyl-6-[(E,4S,6R,8S)-4,6,8-trimethylundec-2-en-2-yl]-4-pyranone IUPAC Name: 2-hydroxy-3,5-dimethyl-6-[(E,4S,6R,8S)-4,6,8-trimethylundec-2-en-2-yl]pyran-4-one Traditional Name: 2-hydroxy-3,5-dimethyl-6-[(E,3S,5R,7S)-1,3,5,7-tetramethyldec-1-enyl]pyran-4-one Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(C)CC(C)C=C(C)C1=C(C(=O)C(=C(O1)O)C)C

Isomeric SMILES

CCC[C@H](C)C[C@@H](C)C[C@H](C)/C=C(\C)/C1=C(C(=O)C(=C(O1)O)C)C

InChI

InChI=1S/C21H34O3/c1-8-9-13(2)10-14(3)11-15(4)12-16(5)20-17(6)19(22)18(7)21(23)24-20/h12-15,23H,8-11H2,1-7H3/b16-12+/t13-,14+,15-/m0/s1