4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]-1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium

Systemtic Name: 4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]-1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium Openeye Name: 1-[(1-methylpyrazol-4-yl)methyl]-4-[4-(m-tolyl)-1H-pyrazol-5-yl]piperidin-1-ium CAS Name: 4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]-1-[(1-methyl-4-pyrazolyl)methyl]piperidin-1-ium IUPAC Name: 4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]-1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium Traditional Name: 1-[(1-methylpyrazol-4-yl)methyl]-4-[4-(m-tolyl)-1H-pyrazol-5-yl]piperidin-1-ium Formula: C20H26N5+ MolecularWeight: 336.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(NN=C2)C3CC[NH+](CC3)CC4=CN(N=C4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(NN=C2)C3CC[NH+](CC3)CC4=CN(N=C4)C

InChI

InChI=1S/C20H25N5/c1-15-4-3-5-18(10-15)19-12-21-23-20(19)17-6-8-25(9-7-17)14-16-11-22-24(2)13-16/h3-5,10-13,17H,6-9,14H2,1-2H3,(H,21,23)/p+1