1-[3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[3-(4-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C23H28N5O+ MolecularWeight: 390.50132

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CN(N=C2C3=CC=C(C=C3)OC)CC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CN(N=C2C3=CC=C(C=C3)OC)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O/c1-26-12-14-27(15-13-26)24-16-21-18-28(17-19-6-4-3-5-7-19)25-23(21)20-8-10-22(29-2)11-9-20/h3-11,16,18H,12-15,17H2,1-2H3/p+1/b24-16-