3-(2-chloranylquinolin-3-yl)-2-phenyl-3,3a-dihydro-1H-pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 3-(2-chloranylquinolin-3-yl)-2-phenyl-3,3a-dihydro-1H-pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 3-(2-chloro-3-quinolyl)-2-phenyl-3,3a-dihydro-1H-pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 3-(2-chloro-3-quinolinyl)-2-phenyl-3,3a-dihydro-1H-pyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 3-(2-chloroquinolin-3-yl)-2-phenyl-3,3a-dihydro-1H-pyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 3-(2-chloro-3-quinolyl)-2-phenyl-3,3a-dihydro-1H-pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C20H14ClN5O2 MolecularWeight: 391.81046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(C3C(=NC(=O)NC3=O)N2)C4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(C3C(=NC(=O)NC3=O)N2)C4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C20H14ClN5O2/c21-17-13(10-11-6-4-5-9-14(11)22-17)16-15-18(23-20(28)24-19(15)27)25-26(16)12-7-2-1-3-8-12/h1-10,15-16H,(H2,23,24,25,27,28)