[(2S)-1-methoxypropan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(2S)-1-methoxypropan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: [(1S)-2-methoxy-1-methyl-ethyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: [(2S)-1-methoxypropan-2-yl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(2S)-1-methoxypropan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [(1S)-2-methoxy-1-methyl-ethyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)[NH2+]CC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](COC)[NH2+]CC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H19N3O/c1-12(11-18-2)15-8-13-9-16-17(10-13)14-6-4-3-5-7-14/h3-7,9-10,12,15H,8,11H2,1-2H3/p+1/t12-/m0/s1