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

Systemtic Name: propan-2-yl 4-[[4-[(2-chloranyl-4-nitro-phenoxy)methyl]phenyl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[[4-[(2-chloro-4-nitro-phenoxy)methyl]benzoyl]amino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[[4-[(2-chloro-4-nitrophenoxy)methyl]phenyl]-oxomethyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[4-[(2-chloro-4-nitrophenoxy)methyl]benzoyl]amino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[[4-[(2-chloro-4-nitro-phenoxy)methyl]benzoyl]amino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C23H23ClN4O6 MolecularWeight: 486.90492

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC=C(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC=C(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H23ClN4O6/c1-4-27-12-19(21(26-27)23(30)34-14(2)3)25-22(29)16-7-5-15(6-8-16)13-33-20-10-9-17(28(31)32)11-18(20)24/h5-12,14H,4,13H2,1-3H3,(H,25,29)