methyl 5-(furan-2-ylcarbonyl)-4-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-3-carboxylate

Systemtic Name: methyl 5-(furan-2-ylcarbonyl)-4-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-3-carboxylate Openeye Name: methyl 5-(furan-2-carbonyl)-4-(p-tolyl)-4,5-dihydro-1H-pyrazole-3-carboxylate CAS Name: 5-[2-furanyl(oxo)methyl]-4-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(furan-2-carbonyl)-4-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-3-carboxylate Traditional Name: 5-(2-furoyl)-4-(p-tolyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(NN=C2C(=O)OC)C(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)C2C(NN=C2C(=O)OC)C(=O)C3=CC=CO3

InChI

InChI=1S/C17H16N2O4/c1-10-5-7-11(8-6-10)13-14(16(20)12-4-3-9-23-12)18-19-15(13)17(21)22-2/h3-9,13-14,18H,1-2H3