bis(4-fluorophenyl)-[1-[3-(4-methoxysulfanylphenoxy)propyl]piperidin-4-yl]methanol

Systemtic Name: bis(4-fluorophenyl)-[1-[3-(4-methoxysulfanylphenoxy)propyl]piperidin-4-yl]methanol Openeye Name: bis(4-fluorophenyl)-[1-[3-(4-methoxysulfanylphenoxy)propyl]-4-piperidyl]methanol CAS Name: 4-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]-1-piperidinyl]propoxy]benzenesulfenic acid methyl ester IUPAC Name: bis(4-fluorophenyl)-[1-[3-(4-methoxysulfanylphenoxy)propyl]piperidin-4-yl]methanol Traditional Name: bis(4-fluorophenyl)-[1-[3-[4-(methoxythio)phenoxy]propyl]-4-piperidyl]methanol Formula: C28H31F2NO3S MolecularWeight: 499.612446

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Descriptors Computed from Structure

Canonical SMILES:

COSC1=CC=C(C=C1)OCCCN2CCC(CC2)C(C3=CC=C(C=C3)F)(C4=CC=C(C=C4)F)O

Isomeric SMILES

COSC1=CC=C(C=C1)OCCCN2CCC(CC2)C(C3=CC=C(C=C3)F)(C4=CC=C(C=C4)F)O

InChI

InChI=1S/C28H31F2NO3S/c1-33-35-27-13-11-26(12-14-27)34-20-2-17-31-18-15-23(16-19-31)28(32,21-3-7-24(29)8-4-21)22-5-9-25(30)10-6-22/h3-14,23,32H,2,15-20H2,1H3