(3R)-3-(3,3-dimethylbut-1-ynyl)-2,5-diphenyl-3,4-dihydropyrazole

Systemtic Name: (3R)-3-(3,3-dimethylbut-1-ynyl)-2,5-diphenyl-3,4-dihydropyrazole Openeye Name: (3R)-3-(3,3-dimethylbut-1-ynyl)-2,5-diphenyl-3,4-dihydropyrazole CAS Name: (3R)-3-(3,3-dimethylbut-1-ynyl)-2,5-diphenyl-3,4-dihydropyrazole IUPAC Name: (3R)-3-(3,3-dimethylbut-1-ynyl)-2,5-diphenyl-3,4-dihydropyrazole Traditional Name: (5R)-5-(3,3-dimethylbut-1-ynyl)-1,3-diphenyl-2-pyrazoline Formula: C21H22N2 MolecularWeight: 302.41278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C#C[C@H]1CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2/c1-21(2,3)15-14-19-16-20(17-10-6-4-7-11-17)22-23(19)18-12-8-5-9-13-18/h4-13,19H,16H2,1-3H3/t19-/m0/s1