1-[(5-bromanyl-2-methoxy-phenyl)-[2-chloranyl-5-(trifluoromethyl)phenyl]methyl]piperazine

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)-[2-chloranyl-5-(trifluoromethyl)phenyl]methyl]piperazine Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]piperazine CAS Name: 1-[(5-bromo-2-methoxyphenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]piperazine IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]piperazine Traditional Name: 1-[(5-bromo-2-methoxy-phenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]piperazine Formula: C19H19BrClF3N2O MolecularWeight: 463.71917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(C2=C(C=CC(=C2)C(F)(F)F)Cl)N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(C2=C(C=CC(=C2)C(F)(F)F)Cl)N3CCNCC3

InChI

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