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

Systemtic Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-hex-5-enyl-piperidine hydrochloride Openeye Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-hex-5-enyl-piperidine hydrochloride CAS Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-hex-5-enylpiperidine hydrochloride IUPAC Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-hex-5-enylpiperidine hydrochloride Traditional Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-hex-5-enyl-piperidine hydrochloride Formula: C25H31ClFNO3 MolecularWeight: 447.969943

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)F.Cl

Isomeric SMILES

C=CCCCCN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)F.Cl

InChI

InChI=1S/C25H30FNO3.ClH/c1-2-3-4-5-13-27-14-12-23(19-6-8-21(26)9-7-19)20(16-27)17-28-22-10-11-24-25(15-22)30-18-29-24;/h2,6-11,15,20,23H,1,3-5,12-14,16-18H2;1H