[(1S)-2-(2-methylphenyl)-1-(1-methylpyrazol-4-yl)ethyl]azanium

Systemtic Name: [(1S)-2-(2-methylphenyl)-1-(1-methylpyrazol-4-yl)ethyl]azanium Openeye Name: [(1S)-1-(1-methylpyrazol-4-yl)-2-(o-tolyl)ethyl]ammonium CAS Name: [(1S)-2-(2-methylphenyl)-1-(1-methyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: [(1S)-2-(2-methylphenyl)-1-(1-methylpyrazol-4-yl)ethyl]azanium Traditional Name: [(1S)-1-(1-methylpyrazol-4-yl)-2-(o-tolyl)ethyl]ammonium Formula: C13H18N3+ MolecularWeight: 216.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C2=CN(N=C2)C)[NH3+]

Isomeric SMILES

CC1=CC=CC=C1C[C@@H](C2=CN(N=C2)C)[NH3+]

InChI

InChI=1S/C13H17N3/c1-10-5-3-4-6-11(10)7-13(14)12-8-15-16(2)9-12/h3-6,8-9,13H,7,14H2,1-2H3/p+1/t13-/m0/s1