N-[3-[bis(2-methylpropyl)amino]-2-oxidanyl-propyl]-2-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: N-[3-[bis(2-methylpropyl)amino]-2-oxidanyl-propyl]-2-nitro-N-phenyl-benzenesulfonamide Openeye Name: N-[3-(diisobutylamino)-2-hydroxy-propyl]-2-nitro-N-phenyl-benzenesulfonamide CAS Name: N-[3-[bis(2-methylpropyl)amino]-2-hydroxypropyl]-2-nitro-N-phenylbenzenesulfonamide IUPAC Name: N-[3-[bis(2-methylpropyl)amino]-2-hydroxypropyl]-2-nitro-N-phenylbenzenesulfonamide Traditional Name: N-[3-(diisobutylamino)-2-hydroxy-propyl]-2-nitro-N-phenyl-benzenesulfonamide Formula: C23H33N3O5S MolecularWeight: 463.59022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O5S/c1-18(2)14-24(15-19(3)4)16-21(27)17-25(20-10-6-5-7-11-20)32(30,31)23-13-9-8-12-22(23)26(28)29/h5-13,18-19,21,27H,14-17H2,1-4H3