[(1S,2S)-1-(1-methylpyrazol-4-yl)-2-phenyl-butyl]azanium

Systemtic Name: [(1S,2S)-1-(1-methylpyrazol-4-yl)-2-phenyl-butyl]azanium Openeye Name: [(1S,2S)-1-(1-methylpyrazol-4-yl)-2-phenyl-butyl]ammonium CAS Name: [(1S,2S)-1-(1-methyl-4-pyrazolyl)-2-phenylbutyl]ammonium IUPAC Name: [(1S,2S)-1-(1-methylpyrazol-4-yl)-2-phenylbutyl]azanium Traditional Name: [(1S,2S)-1-(1-methylpyrazol-4-yl)-2-phenyl-butyl]ammonium Formula: C14H20N3+ MolecularWeight: 230.3287

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(C2=CN(N=C2)C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)[C@@H](C2=CN(N=C2)C)[NH3+]

InChI

InChI=1S/C14H19N3/c1-3-13(11-7-5-4-6-8-11)14(15)12-9-16-17(2)10-12/h4-10,13-14H,3,15H2,1-2H3/p+1/t13-,14+/m0/s1