1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(4-nitrophenyl)piperazine Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(4-nitrophenyl)piperazine IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(4-nitrophenyl)piperazine Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(4-nitrophenyl)piperazine Formula: C17H15BrF3N3O5S MolecularWeight: 510.28231

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C17H15BrF3N3O5S/c18-12-1-6-16(15(11-12)29-17(19,20)21)30(27,28)23-9-7-22(8-10-23)13-2-4-14(5-3-13)24(25)26/h1-6,11H,7-10H2