(3-methoxy-4-phenylmethoxy-phenyl)methyl 4-[4-(trifluoromethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: (3-methoxy-4-phenylmethoxy-phenyl)methyl 4-[4-(trifluoromethyl)phenyl]piperazine-1-carboxylate Openeye Name: (4-benzyloxy-3-methoxy-phenyl)methyl 4-[4-(trifluoromethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxylic acid (3-methoxy-4-phenylmethoxyphenyl)methyl ester IUPAC Name: (3-methoxy-4-phenylmethoxyphenyl)methyl 4-[4-(trifluoromethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-(trifluoromethyl)phenyl]piperazine-1-carboxylic acid (4-benzoxy-3-methoxy-benzyl) ester Formula: C27H27F3N2O4 MolecularWeight: 500.50949

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)COC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(F)(F)F)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)COC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(F)(F)F)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27F3N2O4/c1-34-25-17-21(7-12-24(25)35-18-20-5-3-2-4-6-20)19-36-26(33)32-15-13-31(14-16-32)23-10-8-22(9-11-23)27(28,29)30/h2-12,17H,13-16,18-19H2,1H3