5-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(7,8-dimethyl-2-oxo-chromen-4-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(7,8-dimethyl-2-oxochromen-4-yl)methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H18N4O3 MolecularWeight: 398.41402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)C

InChI

InChI=1S/C23H18N4O3/c1-14-8-9-18-16(10-20(28)30-21(18)15(14)2)12-26-13-24-22-19(23(26)29)11-25-27(22)17-6-4-3-5-7-17/h3-11,13H,12H2,1-2H3