3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-octyl-piperidine hydrochloride

Systemtic Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-octyl-piperidine hydrochloride Openeye Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-octyl-piperidine hydrochloride CAS Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-octylpiperidine hydrochloride IUPAC Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-octylpiperidine hydrochloride Traditional Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-octyl-piperidine hydrochloride Formula: C27H37ClFNO3 MolecularWeight: 478.038983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)F.Cl

Isomeric SMILES

CCCCCCCCN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)F.Cl

InChI

InChI=1S/C27H36FNO3.ClH/c1-2-3-4-5-6-7-15-29-16-14-25(21-8-10-23(28)11-9-21)22(18-29)19-30-24-12-13-26-27(17-24)32-20-31-26;/h8-13,17,22,25H,2-7,14-16,18-20H2,1H3;1H