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

Systemtic Name: methyl (3S,4R)-2-(4-methoxyphenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylate Openeye Name: methyl (3S,4R)-2-(4-methoxyphenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylate CAS Name: (3S,4R)-2-(4-methoxyphenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-2-(4-methoxyphenyl)-3,5-diphenyl-3,4-dihydropyrazole-4-carboxylate Traditional Name: (4R,5S)-1-(4-methoxyphenyl)-3,5-diphenyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C(=N2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@@H]([C@H](C(=N2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O3/c1-28-20-15-13-19(14-16-20)26-23(18-11-7-4-8-12-18)21(24(27)29-2)22(25-26)17-9-5-3-6-10-17/h3-16,21,23H,1-2H3/t21-,23+/m0/s1