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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]azanium Traditional Name: [4-(4-chlorobenzyl)oxy-3-ethoxy-benzyl]-piperonyl-ammonium Formula: C24H25ClNO4+ MolecularWeight: 426.9126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3)OCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3)OCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H24ClNO4/c1-2-27-23-11-18(5-9-21(23)28-15-17-3-7-20(25)8-4-17)13-26-14-19-6-10-22-24(12-19)30-16-29-22/h3-12,26H,2,13-16H2,1H3/p+1