[2-[(4-fluoranyl-3-methoxy-phenyl)methyl]-4-(phenylmethyl)piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone

Systemtic Name: [2-[(4-fluoranyl-3-methoxy-phenyl)methyl]-4-(phenylmethyl)piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Openeye Name: [4-benzyl-2-[(4-fluoro-3-methoxy-phenyl)methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone CAS Name: [2-[(4-fluoro-3-methoxyphenyl)methyl]-4-(phenylmethyl)-1-piperazinyl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-benzyl-2-[(4-fluoro-3-methoxyphenyl)methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Traditional Name: [4-benzyl-2-(4-fluoro-3-methoxy-benzyl)piperazino]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Formula: C28H28F4N2O3 MolecularWeight: 516.527133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(F)(F)F)C(=O)N2CCN(CC2CC3=CC(=C(C=C3)F)OC)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1)C(F)(F)F)C(=O)N2CCN(CC2CC3=CC(=C(C=C3)F)OC)CC4=CC=CC=C4

InChI

InChI=1S/C28H28F4N2O3/c1-36-24-15-21(14-22(16-24)28(30,31)32)27(35)34-11-10-33(17-19-6-4-3-5-7-19)18-23(34)12-20-8-9-25(29)26(13-20)37-2/h3-9,13-16,23H,10-12,17-18H2,1-2H3