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

Systemtic Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine; methylbenzene; hydrochloride Openeye Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine; toluene; hydrochloride CAS Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine; toluene; hydrochloride IUPAC Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine; toluene; hydrochloride Traditional Name: 3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine; toluene; hydrochloride Formula: C26H29ClFNO3 MolecularWeight: 457.964763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C1CNCC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4.Cl

Isomeric SMILES

CC1=CC=CC=C1.C1CNCC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4.Cl

InChI

InChI=1S/C19H20FNO3.C7H8.ClH/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18;1-7-5-3-2-4-6-7;/h1-6,9,14,17,21H,7-8,10-12H2;2-6H,1H3;1H