1,3-benzodioxol-5-ylmethyl-[[5-bromanyl-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[5-bromanyl-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: [5-bromo-2-(2,4-dichlorobenzyl)oxy-benzyl]-piperonyl-ammonium Formula: C22H19BrCl2NO3+ MolecularWeight: 496.20116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18BrCl2NO3/c23-17-3-6-20(27-12-15-2-4-18(24)9-19(15)25)16(8-17)11-26-10-14-1-5-21-22(7-14)29-13-28-21/h1-9,26H,10-13H2/p+1