(3,5-dimethoxy-4-phenylmethoxy-phenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dimethoxy-4-phenylmethoxy-phenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone Openeye Name: (4-benzyloxy-3,5-dimethoxy-phenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone CAS Name: (3,5-dimethoxy-4-phenylmethoxyphenyl)-[4-(4-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: (3,5-dimethoxy-4-phenylmethoxyphenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone Traditional Name: (4-benzoxy-3,5-dimethoxy-phenyl)-[4-(4-fluorophenyl)piperazino]methanone Formula: C26H27FN2O4 MolecularWeight: 450.501983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H27FN2O4/c1-31-23-16-20(17-24(32-2)25(23)33-18-19-6-4-3-5-7-19)26(30)29-14-12-28(13-15-29)22-10-8-21(27)9-11-22/h3-11,16-17H,12-15,18H2,1-2H3