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

Systemtic Name: methyl (3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: methyl (3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazole-3-carboxylate CAS Name: (3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: (3R,4S)-2,4,5-triphenyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H]1[C@@H](C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O2/c1-27-23(26)22-20(17-11-5-2-6-12-17)21(18-13-7-3-8-14-18)24-25(22)19-15-9-4-10-16-19/h2-16,20,22H,1H3/t20-,22-/m1/s1