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

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2-methoxyphenyl)piperazine CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2-methoxyphenyl)piperazine IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2-methoxyphenyl)piperazine Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2-methoxyphenyl)piperazine Formula: C18H18BrF3N2O4S MolecularWeight: 495.31073

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C18H18BrF3N2O4S/c1-27-15-5-3-2-4-14(15)23-8-10-24(11-9-23)29(25,26)17-7-6-13(19)12-16(17)28-18(20,21)22/h2-7,12H,8-11H2,1H3