methyl 3-bromanyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: methyl 3-bromanyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: methyl 3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 3-bromo-5-(3-nitrophenyl)-7-pyrazolo[1,5-a]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester Formula: C14H9BrN4O4 MolecularWeight: 377.14966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C(C=NN12)Br)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=NC2=C(C=NN12)Br)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9BrN4O4/c1-23-14(20)12-6-11(17-13-10(15)7-16-18(12)13)8-3-2-4-9(5-8)19(21)22/h2-7H,1H3