[(2S,3R)-3-nitro-2-phenylsulfanyl-3-(phenylsulfonyl)propyl]benzene

Systemtic Name: [(2S,3R)-3-nitro-2-phenylsulfanyl-3-(phenylsulfonyl)propyl]benzene Openeye Name: [(2S,3R)-3-(benzenesulfonyl)-3-nitro-2-phenylsulfanyl-propyl]benzene CAS Name: [(2S,3R)-3-(benzenesulfonyl)-3-nitro-2-(phenylthio)propyl]benzene IUPAC Name: [(2S,3R)-3-(benzenesulfonyl)-3-nitro-2-phenylsulfanylpropyl]benzene Traditional Name: [(2S,3R)-3-besyl-3-nitro-2-(phenylthio)propyl]benzene Formula: C21H19NO4S2 MolecularWeight: 413.50986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C([N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H]([C@H]([N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4S2/c23-22(24)21(28(25,26)19-14-8-3-9-15-19)20(16-17-10-4-1-5-11-17)27-18-12-6-2-7-13-18/h1-15,20-21H,16H2/t20-,21+/m0/s1