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

Systemtic Name: 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-furan-2-yl)-2-oxidanylidene-ethyl]amino]-1H-pyrazole-4-carboxylic acid Openeye Name: 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-2-furyl)-2-oxo-ethyl]amino]-1H-pyrazole-4-carboxylic acid CAS Name: 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methyl-2-furanyl)-2-oxoethyl]amino]-1H-pyrazole-4-carboxylic acid IUPAC Name: 5-[[2-ethoxy-1-(4-ethoxycarbonyl-5-methylfuran-2-yl)-2-oxoethyl]amino]-1H-pyrazole-4-carboxylic acid Traditional Name: 5-[[1-(4-carbethoxy-5-methyl-2-furyl)-2-ethoxy-2-keto-ethyl]amino]-1H-pyrazole-4-carboxylic acid Formula: C16H19N3O7 MolecularWeight: 365.33796

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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)O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O7/c1-4-24-15(22)9-6-11(26-8(9)3)12(16(23)25-5-2)18-13-10(14(20)21)7-17-19-13/h6-7,12H,4-5H2,1-3H3,(H,20,21)(H2,17,18,19)