[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C18H26N4O3+2 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC[NH2+]CC2=C(NN=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCC[NH+]1CCC[NH2+]CC2=C(NN=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H24N4O3/c1(5-22-6-8-23-9-7-22)4-19-11-15-12-20-21-18(15)14-2-3-16-17(10-14)25-13-24-16/h2-3,10,12,19H,1,4-9,11,13H2,(H,20,21)/p+2