(3S,6S)-6-(4-nitrophenyl)sulfanylthian-3-ol

Systemtic Name: (3S,6S)-6-(4-nitrophenyl)sulfanylthian-3-ol Openeye Name: (3S,6S)-6-(4-nitrophenyl)sulfanyltetrahydrothiopyran-3-ol CAS Name: (3S,6S)-6-[(4-nitrophenyl)thio]-3-thianol IUPAC Name: (3S,6S)-6-(4-nitrophenyl)sulfanylthian-3-ol Traditional Name: (3S,6S)-6-[(4-nitrophenyl)thio]tetrahydrothiopyran-3-ol Formula: C11H13NO3S2 MolecularWeight: 271.35582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(SCC1O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](SC[C@H]1O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO3S2/c13-9-3-6-11(16-7-9)17-10-4-1-8(2-5-10)12(14)15/h1-2,4-5,9,11,13H,3,6-7H2/t9-,11-/m0/s1