(4R,5S,6S)-2-(1,3-dithian-2-yl)-2,4,6-trimethyl-5-oxidanyl-undec-10-yn-3-one

Systemtic Name: (4R,5S,6S)-2-(1,3-dithian-2-yl)-2,4,6-trimethyl-5-oxidanyl-undec-10-yn-3-one Openeye Name: (4R,5S,6S)-2-(1,3-dithian-2-yl)-5-hydroxy-2,4,6-trimethyl-undec-10-yn-3-one CAS Name: (4R,5S,6S)-2-(1,3-dithian-2-yl)-5-hydroxy-2,4,6-trimethyl-10-undecyn-3-one IUPAC Name: (4R,5S,6S)-2-(1,3-dithian-2-yl)-5-hydroxy-2,4,6-trimethylundec-10-yn-3-one Traditional Name: (4R,5S,6S)-2-(1,3-dithian-2-yl)-5-hydroxy-2,4,6-trimethyl-undec-10-yn-3-one Formula: C18H30O2S2 MolecularWeight: 342.5596

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC#C)C(C(C)C(=O)C(C)(C)C1SCCCS1)O

Isomeric SMILES

C[C@@H](CCCC#C)[C@@H]([C@@H](C)C(=O)C(C)(C)C1SCCCS1)O

InChI

InChI=1S/C18H30O2S2/c1-6-7-8-10-13(2)15(19)14(3)16(20)18(4,5)17-21-11-9-12-22-17/h1,13-15,17,19H,7-12H2,2-5H3/t13-,14+,15-/m0/s1