ethyl 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-furan-2-yl)-2-oxidanylidene-ethyl]amino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-furan-2-yl)-2-oxidanylidene-ethyl]amino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-2-furyl)-2-oxo-ethyl]amino]-1H-pyrazole-4-carboxylate CAS Name: 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-2-furanyl)-2-oxoethyl]amino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methylfuran-2-yl)-2-oxoethyl]amino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[[1-(4-carbethoxy-5-methyl-2-furyl)-2-ethoxy-2-keto-ethyl]amino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C18H23N3O7 MolecularWeight: 393.39112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1)C(C(=O)OCC)NC2=C(C=NN2)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1)C(C(=O)OCC)NC2=C(C=NN2)C(=O)OCC)C

InChI

InChI=1S/C18H23N3O7/c1-5-25-16(22)11-8-13(28-10(11)4)14(18(24)27-7-3)20-15-12(9-19-21-15)17(23)26-6-2/h8-9,14H,5-7H2,1-4H3,(H2,19,20,21)