(5-ethanoyl-2-methoxy-phenyl)methyl 3-(4-methylphenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-(4-methylphenyl)-1H-pyrazole-5-carboxylate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-(p-tolyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-methylphenyl)-1H-pyrazole-5-carboxylic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-(4-methylphenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(p-tolyl)-1H-pyrazole-5-carboxylic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C21H20N2O4/c1-13-4-6-15(7-5-13)18-11-19(23-22-18)21(25)27-12-17-10-16(14(2)24)8-9-20(17)26-3/h4-11H,12H2,1-3H3,(H,22,23)