1-(6-methylpyridin-1-ium-2-yl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium

Systemtic Name: 1-(6-methylpyridin-1-ium-2-yl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Openeye Name: 1-(6-methylpyridin-1-ium-2-yl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium CAS Name: 1-(6-methyl-2-pyridin-1-iumyl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium IUPAC Name: 1-(6-methylpyridin-1-ium-2-yl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Traditional Name: 1-(6-methylpyridin-1-ium-2-yl)-4-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Formula: C23H31N5O3+2 MolecularWeight: 425.52394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2CC[NH+](CC2)CC3=C(NN=C3)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2CC[NH+](CC2)CC3=C(NN=C3)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C23H29N5O3/c1-16-6-5-7-21(25-16)28-10-8-27(9-11-28)15-18-14-24-26-22(18)17-12-19(29-2)23(31-4)20(13-17)30-3/h5-7,12-14H,8-11,15H2,1-4H3,(H,24,26)/p+2