N-[(2R)-3-(dibutylamino)-2-oxidanyl-propyl]-4-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: N-[(2R)-3-(dibutylamino)-2-oxidanyl-propyl]-4-nitro-N-phenyl-benzenesulfonamide Openeye Name: N-[(2R)-3-(dibutylamino)-2-hydroxy-propyl]-4-nitro-N-phenyl-benzenesulfonamide CAS Name: N-[(2R)-3-(dibutylamino)-2-hydroxypropyl]-4-nitro-N-phenylbenzenesulfonamide IUPAC Name: N-[(2R)-3-(dibutylamino)-2-hydroxypropyl]-4-nitro-N-phenylbenzenesulfonamide Traditional Name: N-[(2R)-3-(dibutylamino)-2-hydroxy-propyl]-4-nitro-N-phenyl-benzenesulfonamide Formula: C23H33N3O5S MolecularWeight: 463.59022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O5S/c1-3-5-16-24(17-6-4-2)18-22(27)19-25(20-10-8-7-9-11-20)32(30,31)23-14-12-21(13-15-23)26(28)29/h7-15,22,27H,3-6,16-19H2,1-2H3/t22-/m1/s1