ethyl 2-methyl-5-[(5-nitropyridin-2-yl)carbamoyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[(5-nitropyridin-2-yl)carbamoyl]pyrazole-3-carboxylate Openeye Name: ethyl 2-methyl-5-[(5-nitro-2-pyridyl)carbamoyl]pyrazole-3-carboxylate CAS Name: 2-methyl-5-[[(5-nitro-2-pyridinyl)amino]-oxomethyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-[(5-nitropyridin-2-yl)carbamoyl]pyrazole-3-carboxylate Traditional Name: 2-methyl-5-[(5-nitro-2-pyridyl)carbamoyl]pyrazole-3-carboxylic acid ethyl ester Formula: C13H13N5O5 MolecularWeight: 319.27282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5/c1-3-23-13(20)10-6-9(16-17(10)2)12(19)15-11-5-4-8(7-14-11)18(21)22/h4-7H,3H2,1-2H3,(H,14,15,19)