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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[5-chloranyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: [5-chloro-2-(4-chlorobenzyl)oxy-benzyl]-piperonyl-ammonium Formula: C22H20Cl2NO3+ MolecularWeight: 417.3051

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19Cl2NO3/c23-18-4-1-15(2-5-18)13-26-20-8-6-19(24)10-17(20)12-25-11-16-3-7-21-22(9-16)28-14-27-21/h1-10,25H,11-14H2/p+1