[(1S)-1-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(3,5-dimethyl-1-pyrazolyl)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]ammonium Formula: C13H18N3+ MolecularWeight: 216.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2C(C)[NH3+])C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2[C@H](C)[NH3+])C

InChI

InChI=1S/C13H17N3/c1-9-8-10(2)16(15-9)13-7-5-4-6-12(13)11(3)14/h4-8,11H,14H2,1-3H3/p+1/t11-/m0/s1