1-[4-[3-[4-[bis(4-fluorophenyl)-oxidanyl-methyl]piperidin-1-yl]propoxy]-2-methoxy-phenyl]ethanone chloride

Systemtic Name: 1-[4-[3-[4-[bis(4-fluorophenyl)-oxidanyl-methyl]piperidin-1-yl]propoxy]-2-methoxy-phenyl]ethanone chloride Openeye Name: 1-[4-[3-[4-[bis(4-fluorophenyl)-hydroxy-methyl]-1-piperidyl]propoxy]-2-methoxy-phenyl]ethanone chloride CAS Name: 1-[4-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]-1-piperidinyl]propoxy]-2-methoxyphenyl]ethanone chloride IUPAC Name: 1-[4-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]propoxy]-2-methoxyphenyl]ethanone chloride Traditional Name: 1-[4-[3-[4-[bis(4-fluorophenyl)-hydroxy-methyl]piperidino]propoxy]-2-methoxy-phenyl]ethanone chloride Formula: C30H33ClF2NO4- MolecularWeight: 545.037126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCCCN2CCC(CC2)C(C3=CC=C(C=C3)F)(C4=CC=C(C=C4)F)O)OC.[Cl-]

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCCCN2CCC(CC2)C(C3=CC=C(C=C3)F)(C4=CC=C(C=C4)F)O)OC.[Cl-]

InChI

InChI=1S/C30H33F2NO4.ClH/c1-21(34)28-13-12-27(20-29(28)36-2)37-19-3-16-33-17-14-24(15-18-33)30(35,22-4-8-25(31)9-5-22)23-6-10-26(32)11-7-23;/h4-13,20,24,35H,3,14-19H2,1-2H3;1H/p-1