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

Systemtic Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C28H25N6+ MolecularWeight: 445.5383

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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

Isomeric SMILES

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

InChI

InChI=1S/C28H24N6/c1-2-8-20(9-3-1)34-28-25(18-31-34)27(29-19-30-28)33-16-14-32(15-17-33)26-23-12-6-4-10-21(23)22-11-5-7-13-24(22)26/h1-13,18-19,26H,14-17H2/p+1