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

Systemtic Name: (4-bromanyl-3-nitro-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-bromo-3-nitro-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (4-bromo-3-nitrophenyl)-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-bromo-3-nitrophenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-bromo-3-nitro-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazino]methanone Formula: C17H15BrFN3O5S MolecularWeight: 472.285503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15BrFN3O5S/c18-15-6-1-12(11-16(15)22(24)25)17(23)20-7-9-21(10-8-20)28(26,27)14-4-2-13(19)3-5-14/h1-6,11H,7-10H2