[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-[(4-methylphenyl)methyl]azanium Openeye Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(p-tolylmethyl)ammonium CAS Name: [(1S)-1-(1,3-dimethyl-4-pyrazolyl)ethyl]-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-[(4-methylphenyl)methyl]azanium Traditional Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(4-methylbenzyl)ammonium Formula: C15H22N3+ MolecularWeight: 244.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]C(C)C2=CN(N=C2C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+][C@@H](C)C2=CN(N=C2C)C

InChI

InChI=1S/C15H21N3/c1-11-5-7-14(8-6-11)9-16-12(2)15-10-18(4)17-13(15)3/h5-8,10,12,16H,9H2,1-4H3/p+1/t12-/m0/s1