(4-aminophenyl)methyl-(1,3-benzodioxol-5-ylmethyl)-methyl-azanium

Systemtic Name: (4-aminophenyl)methyl-(1,3-benzodioxol-5-ylmethyl)-methyl-azanium Openeye Name: (4-aminophenyl)methyl-(1,3-benzodioxol-5-ylmethyl)-methyl-ammonium CAS Name: (4-aminophenyl)methyl-(1,3-benzodioxol-5-ylmethyl)-methylammonium IUPAC Name: (4-aminophenyl)methyl-(1,3-benzodioxol-5-ylmethyl)-methylazanium Traditional Name: (4-aminobenzyl)-methyl-piperonyl-ammonium Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H18N2O2/c1-18(9-12-2-5-14(17)6-3-12)10-13-4-7-15-16(8-13)20-11-19-15/h2-8H,9-11,17H2,1H3/p+1