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

Systemtic Name: [(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [(1S)-2-ammonio-1-(1-methyl-4-pyrazolyl)ethyl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(1S)-2-azaniumyl-1-(1-methylpyrazol-4-yl)ethyl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [(1S)-2-ammonio-1-(1-methylpyrazol-4-yl)ethyl]-methyl-(4-methylbenzyl)ammonium Formula: C15H24N4+2 MolecularWeight: 260.37786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)C(C[NH3+])C2=CN(N=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)[C@H](C[NH3+])C2=CN(N=C2)C

InChI

InChI=1S/C15H22N4/c1-12-4-6-13(7-5-12)10-18(2)15(8-16)14-9-17-19(3)11-14/h4-7,9,11,15H,8,10,16H2,1-3H3/p+2/t15-/m1/s1