ethyl 1-methyl-5-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-methyl-5-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-methyl-5-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]pyrazole-4-carboxylate CAS Name: 1-methyl-5-[[[1-[(2-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]pyrazole-4-carboxylate Traditional Name: 1-methyl-5-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C18H18N6O6 MolecularWeight: 414.37212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O6/c1-3-29-18(26)12-10-19-22(2)16(12)20-17(25)13-8-9-23(21-13)11-30-15-7-5-4-6-14(15)24(27)28/h4-10H,3,11H2,1-2H3,(H,20,25)