4-[[1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-N-(furan-2-ylmethyl)-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-[[1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-N-(furan-2-ylmethyl)-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-[[1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carbonyl]amino]-N-(2-furylmethyl)-1-methyl-pyrazole-3-carboxamide CAS Name: 4-[[[1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-N-(2-furanylmethyl)-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-[[1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide Traditional Name: 4-[[1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carbonyl]amino]-N-(2-furfuryl)-1-methyl-pyrazole-3-carboxamide Formula: C21H18ClN7O6 MolecularWeight: 499.86392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)C3=NN(C=C3)COC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)C3=NN(C=C3)COC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H18ClN7O6/c1-27-11-17(19(26-27)21(31)23-10-14-3-2-8-34-14)24-20(30)16-6-7-28(25-16)12-35-18-5-4-13(29(32)33)9-15(18)22/h2-9,11H,10,12H2,1H3,(H,23,31)(H,24,30)