[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium

Systemtic Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium Openeye Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)ammonium CAS Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-pyrazolyl]methyl-[3-(1-pyrazolyl)propyl]ammonium IUPAC Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylpyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium Traditional Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)ammonium Formula: C19H24N5O2+ MolecularWeight: 354.42616

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCO3)C[NH2+]CCCN4C=CC=N4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCO3)C[NH2+]CCCN4C=CC=N4

InChI

InChI=1S/C19H23N5O2/c1-23-14-16(13-20-6-2-8-24-9-3-7-21-24)19(22-23)15-4-5-17-18(12-15)26-11-10-25-17/h3-5,7,9,12,14,20H,2,6,8,10-11,13H2,1H3/p+1