1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-[4-chloranyl-3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-[4-chloranyl-3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-[(3-bromo-4-methoxy-phenyl)methyl]-4-[4-chloro-3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-[4-chloro-3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-[4-chloro-3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(3-bromo-4-methoxy-benzyl)-4-[4-chloro-3-(trifluoromethyl)phenyl]piperazine Formula: C19H19BrClF3N2O MolecularWeight: 463.71917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)C(F)(F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)C(F)(F)F)Br

InChI

InChI=1S/C19H19BrClF3N2O/c1-27-18-5-2-13(10-16(18)20)12-25-6-8-26(9-7-25)14-3-4-17(21)15(11-14)19(22,23)24/h2-5,10-11H,6-9,12H2,1H3