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

Systemtic Name: ethyl 5-[[5-[(4-ethanoylphenoxy)methyl]furan-2-yl]carbonylamino]-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[5-[(4-acetylphenoxy)methyl]furan-2-carbonyl]amino]-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[[5-[(4-acetylphenoxy)methyl]-2-furanyl]-oxomethyl]amino]-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[5-[(4-acetylphenoxy)methyl]furan-2-carbonyl]amino]-1-methylpyrazole-4-carboxylate Traditional Name: 5-[[5-[(4-acetylphenoxy)methyl]-2-furoyl]amino]-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H21N3O6/c1-4-28-21(27)17-11-22-24(3)19(17)23-20(26)18-10-9-16(30-18)12-29-15-7-5-14(6-8-15)13(2)25/h5-11H,4,12H2,1-3H3,(H,23,26)