(7-methoxy-1,3-benzodioxol-5-yl)methyl-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]azanium

Systemtic Name: (7-methoxy-1,3-benzodioxol-5-yl)methyl-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]azanium Openeye Name: (7-methoxy-1,3-benzodioxol-5-yl)methyl-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]ammonium CAS Name: (7-methoxy-1,3-benzodioxol-5-yl)methyl-[[2-(1-pyrazolylmethyl)phenyl]methyl]ammonium IUPAC Name: (7-methoxy-1,3-benzodioxol-5-yl)methyl-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]azanium Traditional Name: (7-methoxy-1,3-benzodioxol-5-yl)methyl-[2-(pyrazol-1-ylmethyl)benzyl]ammonium Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C[NH2+]CC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C[NH2+]CC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C20H21N3O3/c1-24-18-9-15(10-19-20(18)26-14-25-19)11-21-12-16-5-2-3-6-17(16)13-23-8-4-7-22-23/h2-10,21H,11-14H2,1H3/p+1