N-[(2S)-3-(dimethylamino)-2-oxidanyl-propyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide

Systemtic Name: N-[(2S)-3-(dimethylamino)-2-oxidanyl-propyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide Openeye Name: N-[(2S)-3-(dimethylamino)-2-hydroxy-propyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide CAS Name: N-[(2S)-3-(dimethylamino)-2-hydroxypropyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide IUPAC Name: N-[(2S)-3-(dimethylamino)-2-hydroxypropyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide Traditional Name: N-[(2S)-3-(dimethylamino)-2-hydroxy-propyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide Formula: C18H23N3O5S MolecularWeight: 393.45732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN(C)C)O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C[C@H](CN(C)C)O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c1-14-8-10-16(11-9-14)27(25,26)20(13-15(22)12-19(2)3)17-6-4-5-7-18(17)21(23)24/h4-11,15,22H,12-13H2,1-3H3/t15-/m0/s1