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

Systemtic Name: methyl 1-ethyl-4-[[5-[(4-propylphenoxy)methyl]furan-2-yl]carbonylamino]pyrazole-3-carboxylate Openeye Name: methyl 1-ethyl-4-[[5-[(4-propylphenoxy)methyl]furan-2-carbonyl]amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[oxo-[5-[(4-propylphenoxy)methyl]-2-furanyl]methyl]amino]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-4-[[5-[(4-propylphenoxy)methyl]furan-2-carbonyl]amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[[5-[(4-propylphenoxy)methyl]-2-furoyl]amino]pyrazole-3-carboxylic acid methyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CN(N=C3C(=O)OC)CC

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CN(N=C3C(=O)OC)CC

InChI

InChI=1S/C22H25N3O5/c1-4-6-15-7-9-16(10-8-15)29-14-17-11-12-19(30-17)21(26)23-18-13-25(5-2)24-20(18)22(27)28-3/h7-13H,4-6,14H2,1-3H3,(H,23,26)