(4S,6R)-4-(hydroxymethyl)-1-methyl-6-oxidanyl-4-phenylsulfanyl-azocan-5-one

Systemtic Name: (4S,6R)-4-(hydroxymethyl)-1-methyl-6-oxidanyl-4-phenylsulfanyl-azocan-5-one Openeye Name: (4S,6R)-6-hydroxy-4-(hydroxymethyl)-1-methyl-4-phenylsulfanyl-azocan-5-one CAS Name: (4S,6R)-6-hydroxy-4-(hydroxymethyl)-1-methyl-4-(phenylthio)-5-azocanone IUPAC Name: (4S,6R)-6-hydroxy-4-(hydroxymethyl)-1-methyl-4-phenylsulfanylazocan-5-one Traditional Name: (4S,6R)-6-hydroxy-1-methyl-4-methylol-4-(phenylthio)azocan-5-one Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(=O)C(CC1)(CO)SC2=CC=CC=C2)O

Isomeric SMILES

CN1CC[C@H](C(=O)[C@](CC1)(CO)SC2=CC=CC=C2)O

InChI

InChI=1S/C15H21NO3S/c1-16-9-7-13(18)14(19)15(11-17,8-10-16)20-12-5-3-2-4-6-12/h2-6,13,17-18H,7-11H2,1H3/t13-,15+/m1/s1