(2-methyl-1-oxidanyl-propan-2-yl)-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: (2-methyl-1-oxidanyl-propan-2-yl)-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: (1-hydroxy-2-methylpropan-2-yl)-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: (1-hydroxy-2-methylpropan-2-yl)-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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