1-nitro-1-(phenylsulfonyl)butan-2-ol

Systemtic Name: 1-nitro-1-(phenylsulfonyl)butan-2-ol Openeye Name: 1-(benzenesulfonyl)-1-nitro-butan-2-ol CAS Name: 1-(benzenesulfonyl)-1-nitro-2-butanol IUPAC Name: 1-(benzenesulfonyl)-1-nitrobutan-2-ol Traditional Name: 1-besyl-1-nitro-butan-2-ol Formula: C10H13NO5S MolecularWeight: 259.27892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO5S/c1-2-9(12)10(11(13)14)17(15,16)8-6-4-3-5-7-8/h3-7,9-10,12H,2H2,1H3