[(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-methyl-(phenylmethyl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-benzyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(1-methyl-4-pyrazolyl)ethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-benzyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(1-methylpyrazol-4-yl)ethyl]-benzyl-methyl-ammonium Formula: C14H22N4+2 MolecularWeight: 246.35128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(C[NH3+])[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=N1)[C@@H](C[NH3+])[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C14H20N4/c1-17(10-12-6-4-3-5-7-12)14(8-15)13-9-16-18(2)11-13/h3-7,9,11,14H,8,10,15H2,1-2H3/p+2/t14-/m1/s1