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

Systemtic Name: methyl (3R,4S)-4-methyl-2,5-diphenyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: methyl (3R,4S)-4-methyl-2,5-diphenyl-3,4-dihydropyrazole-3-carboxylate CAS Name: (3R,4S)-4-methyl-2,5-diphenyl-3,4-dihydropyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-4-methyl-2,5-diphenyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: (3R,4S)-4-methyl-2,5-diphenyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C18H18N2O2 MolecularWeight: 294.34772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O2/c1-13-16(14-9-5-3-6-10-14)19-20(17(13)18(21)22-2)15-11-7-4-8-12-15/h3-13,17H,1-2H3/t13-,17-/m1/s1