methyl 2-[[1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carbonyl]amino]acetate CAS Name: 2-[[[1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]acetate Traditional Name: 2-[[1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carbonyl]amino]acetic acid methyl ester Formula: C14H13ClN4O6 MolecularWeight: 368.72922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)CNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN4O6/c1-24-13(20)7-16-14(21)11-4-5-18(17-11)8-25-12-3-2-9(19(22)23)6-10(12)15/h2-6H,7-8H2,1H3,(H,16,21)