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

Systemtic Name: methyl 4-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-carbonyl]amino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[[5-[(3,5-dimethylphenoxy)methyl]-2-furanyl]-oxomethyl]amino]-1-ethyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-carbonyl]amino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[[5-[(3,5-dimethylphenoxy)methyl]-2-furoyl]amino]-1-ethyl-pyrazole-3-carboxylic acid methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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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(=CC(=C3)C)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC)NC(=O)C2=CC=C(O2)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C21H23N3O5/c1-5-24-11-17(19(23-24)21(26)27-4)22-20(25)18-7-6-15(29-18)12-28-16-9-13(2)8-14(3)10-16/h6-11H,5,12H2,1-4H3,(H,22,25)