7-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-4-methyl-chromen-2-one

Systemtic Name: 7-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-4-methyl-chromen-2-one Openeye Name: 7-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-4-methyl-chromen-2-one CAS Name: 7-[[1-(3,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-4-methylchromen-2-one Traditional Name: 7-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-4-methyl-coumarin Formula: C23H18N4O3 MolecularWeight: 398.41402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC5=C(C=C4)C(=CC(=O)O5)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC5=C(C=C4)C(=CC(=O)O5)C)C

InChI

InChI=1S/C23H18N4O3/c1-13-4-5-16(8-14(13)2)27-22-19(11-26-27)23(25-12-24-22)29-17-6-7-18-15(3)9-21(28)30-20(18)10-17/h4-12H,1-3H3