methyl (3R,4R)-3-benzamido-5-(4-chlorophenyl)-2,4-diphenyl-4H-pyrazole-3-carboxylate

Systemtic Name: methyl (3R,4R)-3-benzamido-5-(4-chlorophenyl)-2,4-diphenyl-4H-pyrazole-3-carboxylate Openeye Name: methyl (3R,4R)-3-benzamido-5-(4-chlorophenyl)-2,4-diphenyl-4H-pyrazole-3-carboxylate CAS Name: (3R,4R)-3-benzamido-5-(4-chlorophenyl)-2,4-diphenyl-4H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl (3R,4R)-3-benzamido-5-(4-chlorophenyl)-2,4-diphenyl-4H-pyrazole-3-carboxylate Traditional Name: (3R,4R)-3-benzamido-5-(4-chlorophenyl)-2,4-diphenyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C30H24ClN3O3 MolecularWeight: 509.98286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(C(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)[C@]1([C@@H](C(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H24ClN3O3/c1-37-29(36)30(32-28(35)23-13-7-3-8-14-23)26(21-11-5-2-6-12-21)27(22-17-19-24(31)20-18-22)33-34(30)25-15-9-4-10-16-25/h2-20,26H,1H3,(H,32,35)/t26-,30-/m1/s1