methyl 5-[[2-(1-phenylpyrazol-4-yl)carbonylphenoxy]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2-(1-phenylpyrazol-4-yl)carbonylphenoxy]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[2-(1-phenylpyrazole-4-carbonyl)phenoxy]methyl]furan-2-carboxylate CAS Name: 5-[[2-[oxo-(1-phenyl-4-pyrazolyl)methyl]phenoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(1-phenylpyrazole-4-carbonyl)phenoxy]methyl]furan-2-carboxylate Traditional Name: 5-[[2-(1-phenylpyrazole-4-carbonyl)phenoxy]methyl]furan-2-carboxylic acid methyl ester Formula: C23H18N2O5 MolecularWeight: 402.39942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC2=CC=CC=C2C(=O)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC2=CC=CC=C2C(=O)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O5/c1-28-23(27)21-12-11-18(30-21)15-29-20-10-6-5-9-19(20)22(26)16-13-24-25(14-16)17-7-3-2-4-8-17/h2-14H,15H2,1H3