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

Systemtic Name: methyl 1-ethyl-4-[[5-[(3-methyl-4-nitro-phenoxy)methyl]furan-2-yl]carbonylamino]pyrazole-3-carboxylate Openeye Name: methyl 1-ethyl-4-[[5-[(3-methyl-4-nitro-phenoxy)methyl]furan-2-carbonyl]amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[[5-[(3-methyl-4-nitrophenoxy)methyl]-2-furanyl]-oxomethyl]amino]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-4-[[5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-carbonyl]amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[[5-[(3-methyl-4-nitro-phenoxy)methyl]-2-furoyl]amino]pyrazole-3-carboxylic acid methyl ester Formula: C20H20N4O7 MolecularWeight: 428.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC)NC(=O)C2=CC=C(O2)COC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC)NC(=O)C2=CC=C(O2)COC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O7/c1-4-23-10-15(18(22-23)20(26)29-3)21-19(25)17-8-6-14(31-17)11-30-13-5-7-16(24(27)28)12(2)9-13/h5-10H,4,11H2,1-3H3,(H,21,25)