diethyl 1-methyl-3-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-dicarboxylate

Systemtic Name: diethyl 1-methyl-3-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-dicarboxylate Openeye Name: diethyl 1-methyl-3-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-dicarboxylate CAS Name: 1-methyl-3-phenylpyrazolo[3,4-d]pyrimidine-4,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-methyl-3-phenylpyrazolo[3,4-d]pyrimidine-4,6-dicarboxylate Traditional Name: 1-methyl-3-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-dicarboxylic acid diethyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=NN(C2=NC(=N1)C(=O)OCC)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C2C(=NN(C2=NC(=N1)C(=O)OCC)C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O4/c1-4-25-17(23)14-12-13(11-9-7-6-8-10-11)21-22(3)16(12)20-15(19-14)18(24)26-5-2/h6-10H,4-5H2,1-3H3