4-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxychromen-2-one

Systemtic Name: 4-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxychromen-2-one Openeye Name: 4-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxychromen-2-one CAS Name: 4-[[1-(2,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-1-benzopyran-2-one IUPAC Name: 4-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxychromen-2-one Traditional Name: 4-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxycoumarin Formula: C22H16N4O3 MolecularWeight: 384.38744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC(=O)OC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC(=O)OC5=CC=CC=C54)C

InChI

InChI=1S/C22H16N4O3/c1-13-7-8-17(14(2)9-13)26-21-16(11-25-26)22(24-12-23-21)29-19-10-20(27)28-18-6-4-3-5-15(18)19/h3-12H,1-2H3