[(1R,2S)-1-nitro-1-(phenylsulfonyl)pentan-2-yl]sulfanylmethylbenzene

Systemtic Name: [(1R,2S)-1-nitro-1-(phenylsulfonyl)pentan-2-yl]sulfanylmethylbenzene Openeye Name: [(1S)-1-[(R)-benzenesulfonyl(nitro)methyl]butyl]sulfanylmethylbenzene CAS Name: [[(1R,2S)-1-(benzenesulfonyl)-1-nitropentan-2-yl]thio]methylbenzene IUPAC Name: [(1R,2S)-1-(benzenesulfonyl)-1-nitropentan-2-yl]sulfanylmethylbenzene Traditional Name: [[(1S)-1-[(R)-besyl(nitro)methyl]butyl]thio]methylbenzene Formula: C18H21NO4S2 MolecularWeight: 379.49364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C([N+](=O)[O-])S(=O)(=O)C1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CCC[C@@H]([C@H]([N+](=O)[O-])S(=O)(=O)C1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO4S2/c1-2-9-17(24-14-15-10-5-3-6-11-15)18(19(20)21)25(22,23)16-12-7-4-8-13-16/h3-8,10-13,17-18H,2,9,14H2,1H3/t17-,18+/m0/s1