methyl 3-bromanyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzoate

Systemtic Name: methyl 3-bromanyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzoate Openeye Name: methyl 3-bromo-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzoate CAS Name: 3-bromo-4-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzoate Traditional Name: 3-bromo-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzoic acid methyl ester Formula: C14H11BrN4O3 MolecularWeight: 363.16614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)OC3=C(C=C(C=C3)C(=O)OC)Br

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)OC3=C(C=C(C=C3)C(=O)OC)Br

InChI

InChI=1S/C14H11BrN4O3/c1-19-12-9(6-18-19)13(17-7-16-12)22-11-4-3-8(5-10(11)15)14(20)21-2/h3-7H,1-2H3