1,3-benzodioxol-5-ylmethyl-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: [3-(4-fluorobenzyl)oxybenzyl]-piperonyl-ammonium Formula: C22H21FNO3+ MolecularWeight: 366.405443

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC(=CC=C3)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC(=CC=C3)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FNO3/c23-19-7-4-16(5-8-19)14-25-20-3-1-2-17(10-20)12-24-13-18-6-9-21-22(11-18)27-15-26-21/h1-11,24H,12-15H2/p+1