ethyl 2-methyl-5-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-methyl-5-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzofuran-3-carboxylate CAS Name: 2-methyl-5-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1-benzofuran-3-carboxylate Traditional Name: 2-methyl-5-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzofuran-3-carboxylic acid ethyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC3=NC=NC4=C3C=NN4C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC3=NC=NC4=C3C=NN4C)C

InChI

InChI=1S/C18H16N4O4/c1-4-24-18(23)15-10(2)25-14-6-5-11(7-12(14)15)26-17-13-8-21-22(3)16(13)19-9-20-17/h5-9H,4H2,1-3H3