[(1S)-1-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]ethyl]azanium Openeye Name: [(1S)-1-[5-methyl-1-(p-tolyl)pyrazol-4-yl]ethyl]ammonium CAS Name: [(1S)-1-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]ethyl]ammonium IUPAC Name: [(1S)-1-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]ethyl]azanium Traditional Name: [(1S)-1-[5-methyl-1-(p-tolyl)pyrazol-4-yl]ethyl]ammonium Formula: C13H18N3+ MolecularWeight: 216.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(C)[NH3+])C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)[C@H](C)[NH3+])C

InChI

InChI=1S/C13H17N3/c1-9-4-6-12(7-5-9)16-11(3)13(8-15-16)10(2)14/h4-8,10H,14H2,1-3H3/p+1/t10-/m0/s1