N-[3-[(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)amino]propyl]methanesulfonamide

Systemtic Name: N-[3-[(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)amino]propyl]methanesulfonamide Openeye Name: N-[3-(2-morpholinosulfonyl-4-nitro-anilino)propyl]methanesulfonamide CAS Name: N-[3-[2-(4-morpholinylsulfonyl)-4-nitroanilino]propyl]methanesulfonamide IUPAC Name: N-[3-(2-morpholin-4-ylsulfonyl-4-nitroanilino)propyl]methanesulfonamide Traditional Name: N-[3-(2-morpholinosulfonyl-4-nitro-anilino)propyl]methanesulfonamide Formula: C14H22N4O7S2 MolecularWeight: 422.47708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCCNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCOCC2

Isomeric SMILES

CS(=O)(=O)NCCCNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C14H22N4O7S2/c1-26(21,22)16-6-2-5-15-13-4-3-12(18(19)20)11-14(13)27(23,24)17-7-9-25-10-8-17/h3-4,11,15-16H,2,5-10H2,1H3