[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C24H32N4+2 MolecularWeight: 376.53768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)C[NH2+]C4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)C[NH2+]C4CC[NH+](CC4)C

InChI

InChI=1S/C24H30N4/c1-18-9-10-19(2)23(15-18)28-17-21(16-25-22-11-13-27(3)14-12-22)24(26-28)20-7-5-4-6-8-20/h4-10,15,17,22,25H,11-14,16H2,1-3H3/p+2