2-[3,5-diethyl-4-(5-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)oxy-pyrazol-1-yl]ethanol

Systemtic Name: 2-[3,5-diethyl-4-(5-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)oxy-pyrazol-1-yl]ethanol Openeye Name: 2-[3,5-diethyl-4-(5-methyl-1-oxido-pyridin-1-ium-3-yl)oxy-pyrazol-1-yl]ethanol CAS Name: 2-[3,5-diethyl-4-[(5-methyl-1-oxido-3-pyridin-1-iumyl)oxy]-1-pyrazolyl]ethanol IUPAC Name: 2-[3,5-diethyl-4-(5-methyl-1-oxidopyridin-1-ium-3-yl)oxypyrazol-1-yl]ethanol Traditional Name: 2-[3,5-diethyl-4-(5-methyl-1-oxido-pyridin-1-ium-3-yl)oxy-pyrazol-1-yl]ethanol Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CCO)CC)OC2=C[N+](=CC(=C2)C)[O-]

Isomeric SMILES

CCC1=C(C(=NN1CCO)CC)OC2=C[N+](=CC(=C2)C)[O-]

InChI

InChI=1S/C15H21N3O3/c1-4-13-15(14(5-2)18(16-13)6-7-19)21-12-8-11(3)9-17(20)10-12/h8-10,19H,4-7H2,1-3H3