6-chloranyl-4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-chloranyl-4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-chloro-4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 6-chloro-4-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 6-chloro-4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-chloro-4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C28H24ClN6+ MolecularWeight: 479.98336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C5=NC(=NC6=C5C=NN6C7=CC=CC=C7)Cl

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C5=NC(=NC6=C5C=NN6C7=CC=CC=C7)Cl

InChI

InChI=1S/C28H23ClN6/c29-28-31-26(24-18-30-35(27(24)32-28)19-8-2-1-3-9-19)34-16-14-33(15-17-34)25-22-12-6-4-10-20(22)21-11-5-7-13-23(21)25/h1-13,18,25H,14-17H2/p+1