ethyl 7-[3-[(3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 7-[3-[(3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 7-[3-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 7-[3-[[(3-methoxy-4-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]phenyl]-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-[3-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C20H17N7O6 MolecularWeight: 451.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N=CC=C(N2N=C1)C3=CC(=CC=C3)NC(=O)C4=C(C(=NN4)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C2N=CC=C(N2N=C1)C3=CC(=CC=C3)NC(=O)C4=C(C(=NN4)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H17N7O6/c1-3-33-20(29)13-10-22-26-14(7-8-21-17(13)26)11-5-4-6-12(9-11)23-18(28)15-16(27(30)31)19(32-2)25-24-15/h4-10H,3H2,1-2H3,(H,23,28)(H,24,25)