4-chloranyl-3-methyl-7-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-2,3-dihydroinden-1-one

Systemtic Name: 4-chloranyl-3-methyl-7-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-2,3-dihydroinden-1-one Openeye Name: 4-chloro-3-methyl-7-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-indan-1-one CAS Name: 4-chloro-3-methyl-7-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]-2,3-dihydroinden-1-one IUPAC Name: 4-chloro-3-methyl-7-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-2,3-dihydroinden-1-one Traditional Name: 4-chloro-3-methyl-7-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-indan-1-one Formula: C21H15ClN4O2 MolecularWeight: 390.8224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)Cl)OC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)Cl)OC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C21H15ClN4O2/c1-12-9-16(27)19-17(8-7-15(22)18(12)19)28-21-14-10-25-26(20(14)23-11-24-21)13-5-3-2-4-6-13/h2-8,10-12H,9H2,1H3