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

Systemtic Name: ethyl 5-[[1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carbonyl]amino]-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[[1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]-1-methylpyrazole-4-carboxylate Traditional Name: 5-[[1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carbonyl]amino]-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C18H17ClN6O6 MolecularWeight: 448.81718

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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=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN6O6/c1-3-30-18(27)12-9-20-23(2)16(12)21-17(26)14-6-7-24(22-14)10-31-15-5-4-11(25(28)29)8-13(15)19/h4-9H,3,10H2,1-2H3,(H,21,26)