4-methyl-N-(3-nitrophenyl)-N-(2-oxidanyl-3-pyrrolidin-1-yl-propyl)benzenesulfonamide hydrochloride

Systemtic Name: 4-methyl-N-(3-nitrophenyl)-N-(2-oxidanyl-3-pyrrolidin-1-yl-propyl)benzenesulfonamide hydrochloride Openeye Name: N-(2-hydroxy-3-pyrrolidin-1-yl-propyl)-4-methyl-N-(3-nitrophenyl)benzenesulfonamide hydrochloride CAS Name: N-[2-hydroxy-3-(1-pyrrolidinyl)propyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide hydrochloride IUPAC Name: N-(2-hydroxy-3-pyrrolidin-1-ylpropyl)-4-methyl-N-(3-nitrophenyl)benzenesulfonamide hydrochloride Traditional Name: N-(2-hydroxy-3-pyrrolidino-propyl)-4-methyl-N-(3-nitrophenyl)benzenesulfonamide hydrochloride Formula: C20H26ClN3O5S MolecularWeight: 455.95554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2CCCC2)O)C3=CC(=CC=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2CCCC2)O)C3=CC(=CC=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C20H25N3O5S.ClH/c1-16-7-9-20(10-8-16)29(27,28)22(15-19(24)14-21-11-2-3-12-21)17-5-4-6-18(13-17)23(25)26;/h4-10,13,19,24H,2-3,11-12,14-15H2,1H3;1H