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

Systemtic Name: methyl (3R,4S)-2,3,5-triphenyl-3,4-dihydropyrazole-4-carboxylate Openeye Name: methyl (3R,4S)-2,3,5-triphenyl-3,4-dihydropyrazole-4-carboxylate CAS Name: (3R,4S)-2,3,5-triphenyl-3,4-dihydropyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-2,3,5-triphenyl-3,4-dihydropyrazole-4-carboxylate Traditional Name: (4S,5R)-1,3,5-triphenyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H]1[C@@H](N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

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