[5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-pyrazol-4-yl]methylazanium

Systemtic Name: [5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-pyrazol-4-yl]methylazanium Openeye Name: [5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-pyrazol-4-yl]methylammonium CAS Name: [5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-4-pyrazolyl]methylammonium IUPAC Name: [5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethylpyrazol-4-yl]methylazanium Traditional Name: (1,3-dimethyl-5-piperonyloxy-pyrazol-4-yl)methylammonium Formula: C14H18N3O3+ MolecularWeight: 276.31102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH3+])OCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=NN(C(=C1C[NH3+])OCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C14H17N3O3/c1-9-11(6-15)14(17(2)16-9)18-7-10-3-4-12-13(5-10)20-8-19-12/h3-5H,6-8,15H2,1-2H3/p+1