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

Systemtic Name: methyl (3S,4R)-2-(4-chlorophenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylate Openeye Name: methyl (3S,4R)-2-(4-chlorophenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylate CAS Name: (3S,4R)-2-(4-chlorophenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-2-(4-chlorophenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylate Traditional Name: (4R,5S)-1-(4-chlorophenyl)-3,5-diphenyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C23H19ClN2O2 MolecularWeight: 390.86216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19ClN2O2/c1-28-23(27)20-21(16-8-4-2-5-9-16)25-26(19-14-12-18(24)13-15-19)22(20)17-10-6-3-7-11-17/h2-15,20,22H,1H3/t20-,22+/m0/s1