1-[4-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)phenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-(4-morpholinosulfonyl-2-nitro-phenoxy)phenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)phenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-(4-morpholinosulfonyl-2-nitro-phenoxy)phenyl]piperazino]ethanone Formula: C22H26N4O7S MolecularWeight: 490.52944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O7S/c1-17(27)23-8-10-24(11-9-23)18-2-4-19(5-3-18)33-22-7-6-20(16-21(22)26(28)29)34(30,31)25-12-14-32-15-13-25/h2-7,16H,8-15H2,1H3