(4S,5R)-5-(4-methoxyphenyl)-4-nitro-thiolan-3-ol

Systemtic Name: (4S,5R)-5-(4-methoxyphenyl)-4-nitro-thiolan-3-ol Openeye Name: (4S,5R)-5-(4-methoxyphenyl)-4-nitro-tetrahydrothiophen-3-ol CAS Name: (4S,5R)-5-(4-methoxyphenyl)-4-nitro-3-thiolanol IUPAC Name: (4S,5R)-5-(4-methoxyphenyl)-4-nitrothiolan-3-ol Traditional Name: (4S,5R)-5-(4-methoxyphenyl)-4-nitro-tetrahydrothiophen-3-ol Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(CS2)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H](C(CS2)O)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO4S/c1-16-8-4-2-7(3-5-8)11-10(12(14)15)9(13)6-17-11/h2-5,9-11,13H,6H2,1H3/t9?,10-,11+/m0/s1