(4-pyrazol-1-ylphenyl)methyl 3-(2,3-dimethoxyphenyl)propanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-(2,3-dimethoxyphenyl)propanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-(2,3-dimethoxyphenyl)propanoate CAS Name: 3-(2,3-dimethoxyphenyl)propanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-(2,3-dimethoxyphenyl)propanoate Traditional Name: 3-(2,3-dimethoxyphenyl)propionic acid (4-pyrazol-1-ylbenzyl) ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CCC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

COC1=CC=CC(=C1OC)CCC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H22N2O4/c1-25-19-6-3-5-17(21(19)26-2)9-12-20(24)27-15-16-7-10-18(11-8-16)23-14-4-13-22-23/h3-8,10-11,13-14H,9,12,15H2,1-2H3