N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-4-pyrrolidino-benzenesulfonamide Formula: C14H21N3O5S MolecularWeight: 343.39864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O5S/c1-11(10-22-2)15-23(20,21)12-5-6-13(14(9-12)17(18)19)16-7-3-4-8-16/h5-6,9,11,15H,3-4,7-8,10H2,1-2H3/t11-/m1/s1