[5-[(2S)-2-ethylhexoxy]-1,3-dimethyl-pyrazol-4-yl]methylazanium

Systemtic Name: [5-[(2S)-2-ethylhexoxy]-1,3-dimethyl-pyrazol-4-yl]methylazanium Openeye Name: [5-[(2S)-2-ethylhexoxy]-1,3-dimethyl-pyrazol-4-yl]methylammonium CAS Name: [5-[(2S)-2-ethylhexoxy]-1,3-dimethyl-4-pyrazolyl]methylammonium IUPAC Name: [5-[(2S)-2-ethylhexoxy]-1,3-dimethylpyrazol-4-yl]methylazanium Traditional Name: [5-[(2S)-2-ethylhexoxy]-1,3-dimethyl-pyrazol-4-yl]methylammonium Formula: C14H28N3O+ MolecularWeight: 254.39162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(C(=NN1C)C)C[NH3+]

Isomeric SMILES

CCCC[C@H](CC)COC1=C(C(=NN1C)C)C[NH3+]

InChI

InChI=1S/C14H27N3O/c1-5-7-8-12(6-2)10-18-14-13(9-15)11(3)16-17(14)4/h12H,5-10,15H2,1-4H3/p+1/t12-/m0/s1