methyl (3S,4R)-5-ethanoyl-2,3-diphenyl-3,4-dihydropyrazole-4-carboxylate

Systemtic Name: methyl (3S,4R)-5-ethanoyl-2,3-diphenyl-3,4-dihydropyrazole-4-carboxylate Openeye Name: methyl (3S,4R)-5-acetyl-2,3-diphenyl-3,4-dihydropyrazole-4-carboxylate CAS Name: (3S,4R)-5-acetyl-2,3-diphenyl-3,4-dihydropyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-5-acetyl-2,3-diphenyl-3,4-dihydropyrazole-4-carboxylate Traditional Name: (4R,5S)-3-acetyl-1,5-diphenyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(C1C(=O)OC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=NN([C@@H]([C@H]1C(=O)OC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3/c1-13(22)17-16(19(23)24-2)18(14-9-5-3-6-10-14)21(20-17)15-11-7-4-8-12-15/h3-12,16,18H,1-2H3/t16-,18+/m0/s1