4-[1-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]morpholine

Systemtic Name: 4-[1-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]morpholine Openeye Name: 4-[1-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]morpholine CAS Name: 4-[1-phenyl-4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-6-pyrazolo[3,4-d]pyrimidinyl]morpholine IUPAC Name: 4-[1-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]morpholine Traditional Name: 4-[1-phenyl-4-(4-pyridin-1-ium-2-ylpiperazino)pyrazolo[3,4-d]pyrimidin-6-yl]morpholine Formula: C24H27N8O+ MolecularWeight: 443.52418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)N6CCOCC6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)N6CCOCC6

InChI

InChI=1S/C24H26N8O/c1-2-6-19(7-3-1)32-23-20(18-26-32)22(27-24(28-23)31-14-16-33-17-15-31)30-12-10-29(11-13-30)21-8-4-5-9-25-21/h1-9,18H,10-17H2/p+1