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

Systemtic Name: methyl 4-(furan-2-yl)-5-(4-methylphenyl)carbonyl-4,5-dihydro-1H-pyrazole-3-carboxylate Openeye Name: methyl 4-(2-furyl)-5-(4-methylbenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate CAS Name: 4-(2-furanyl)-5-[(4-methylphenyl)-oxomethyl]-4,5-dihydro-1H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(furan-2-yl)-5-(4-methylbenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate Traditional Name: 4-(2-furyl)-5-p-toluoyl-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)C(=O)C2C(C(=NN2)C(=O)OC)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(=NN2)C(=O)OC)C3=CC=CO3

InChI

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