methyl 4-[2-[3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[3-(2-furyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[3-(2-furanyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-[5-(2-furyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C21H17N3O7S MolecularWeight: 455.44058

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O7S/c1-29-21(26)13-6-7-18(16(10-13)24(27)28)31-12-20(25)23-15(17-4-2-8-30-17)11-14(22-23)19-5-3-9-32-19/h2-10,15H,11-12H2,1H3