(5-methoxycarbonyl-4-methyl-furan-2-yl)methyl 3-(4-methylphenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: (5-methoxycarbonyl-4-methyl-furan-2-yl)methyl 3-(4-methylphenyl)-1H-pyrazole-5-carboxylate Openeye Name: (5-methoxycarbonyl-4-methyl-2-furyl)methyl 3-(p-tolyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-methylphenyl)-1H-pyrazole-5-carboxylic acid (5-methoxycarbonyl-4-methyl-2-furanyl)methyl ester IUPAC Name: (5-methoxycarbonyl-4-methylfuran-2-yl)methyl 3-(4-methylphenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(p-tolyl)-1H-pyrazole-5-carboxylic acid (5-carbomethoxy-4-methyl-2-furyl)methyl ester Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)OCC3=CC(=C(O3)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)OCC3=CC(=C(O3)C(=O)OC)C

InChI

InChI=1S/C19H18N2O5/c1-11-4-6-13(7-5-11)15-9-16(21-20-15)18(22)25-10-14-8-12(2)17(26-14)19(23)24-3/h4-9H,10H2,1-3H3,(H,20,21)