[(2S)-3-methylbutan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(2S)-3-methylbutan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: [(1S)-1,2-dimethylpropyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: [(2S)-3-methylbutan-2-yl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(2S)-3-methylbutan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [(1S)-1,2-dimethylpropyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C15H22N3+ MolecularWeight: 244.35528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3/c1-12(2)13(3)16-9-14-10-17-18(11-14)15-7-5-4-6-8-15/h4-8,10-13,16H,9H2,1-3H3/p+1/t13-/m0/s1