(1S,2S)-1-(4-nitrophenyl)-2-(phenylsulfonyl)butan-1-ol

Systemtic Name: (1S,2S)-1-(4-nitrophenyl)-2-(phenylsulfonyl)butan-1-ol Openeye Name: (1S,2S)-2-(benzenesulfonyl)-1-(4-nitrophenyl)butan-1-ol CAS Name: (1S,2S)-2-(benzenesulfonyl)-1-(4-nitrophenyl)-1-butanol IUPAC Name: (1S,2S)-2-(benzenesulfonyl)-1-(4-nitrophenyl)butan-1-ol Traditional Name: (1S,2S)-2-besyl-1-(4-nitrophenyl)butan-1-ol Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO5S/c1-2-15(23(21,22)14-6-4-3-5-7-14)16(18)12-8-10-13(11-9-12)17(19)20/h3-11,15-16,18H,2H2,1H3/t15-,16-/m0/s1