[4-(dimethylamino)-3-nitro-phenyl]-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(dimethylamino)-3-nitro-phenyl]-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(dimethylamino)-3-nitro-phenyl]-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(dimethylamino)-3-nitrophenyl]-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(dimethylamino)-3-nitrophenyl]-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(dimethylamino)-3-nitro-phenyl]-[4-(2-fluorophenyl)sulfonylpiperazino]methanone Formula: C19H21FN4O5S MolecularWeight: 436.457243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C19H21FN4O5S/c1-21(2)16-8-7-14(13-17(16)24(26)27)19(25)22-9-11-23(12-10-22)30(28,29)18-6-4-3-5-15(18)20/h3-8,13H,9-12H2,1-2H3