1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[(2-methoxy-4-phenylmethoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[(2-methoxy-4-phenylmethoxy-phenyl)methyl]piperazine Openeye Name: 1-[(4-benzyloxy-2-methoxy-phenyl)methyl]-4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazine CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-[(2-methoxy-4-phenylmethoxyphenyl)methyl]piperazine IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-[(2-methoxy-4-phenylmethoxyphenyl)methyl]piperazine Traditional Name: 1-(4-benzoxy-2-methoxy-benzyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazine Formula: C25H25ClF3N3O2 MolecularWeight: 491.93311

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC2=CC=CC=C2)CN3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)OCC2=CC=CC=C2)CN3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl

InChI

InChI=1S/C25H25ClF3N3O2/c1-33-23-14-21(34-17-18-5-3-2-4-6-18)8-7-19(23)16-31-9-11-32(12-10-31)24-22(26)13-20(15-30-24)25(27,28)29/h2-8,13-15H,9-12,16-17H2,1H3