N-(5-tert-butyl-1H-pyrazol-3-yl)-4-octyl-benzamide

Systemtic Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-4-octyl-benzamide Openeye Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-4-octyl-benzamide CAS Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-4-octylbenzamide IUPAC Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-4-octylbenzamide Traditional Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-4-octyl-benzamide Formula: C22H33N3O MolecularWeight: 355.51692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)NC2=NNC(=C2)C(C)(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)NC2=NNC(=C2)C(C)(C)C

InChI

InChI=1S/C22H33N3O/c1-5-6-7-8-9-10-11-17-12-14-18(15-13-17)21(26)23-20-16-19(24-25-20)22(2,3)4/h12-16H,5-11H2,1-4H3,(H2,23,24,25,26)