[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(2-morpholin-4-yl-5-nitro-phenyl)methanone

Systemtic Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(2-morpholin-4-yl-5-nitro-phenyl)methanone Openeye Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(2-morpholino-5-nitro-phenyl)methanone CAS Name: [4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-[2-(4-morpholinyl)-5-nitrophenyl]methanone IUPAC Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(2-morpholin-4-yl-5-nitrophenyl)methanone Traditional Name: [4-(4-fluorophenyl)sulfonylpiperazino]-(2-morpholino-5-nitro-phenyl)methanone Formula: C21H23FN4O6S MolecularWeight: 478.493923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H23FN4O6S/c22-16-1-4-18(5-2-16)33(30,31)25-9-7-24(8-10-25)21(27)19-15-17(26(28)29)3-6-20(19)23-11-13-32-14-12-23/h1-6,15H,7-14H2