3-[[2-tert-butyl-3-(2,3,4-trimethoxyphenyl)octanoyl]amino]-N-pyridin-4-yl-benzamide

Systemtic Name: 3-[[2-tert-butyl-3-(2,3,4-trimethoxyphenyl)octanoyl]amino]-N-pyridin-4-yl-benzamide Openeye Name: 3-[[2-tert-butyl-3-(2,3,4-trimethoxyphenyl)octanoyl]amino]-N-(4-pyridyl)benzamide CAS Name: 3-[[2-tert-butyl-1-oxo-3-(2,3,4-trimethoxyphenyl)octyl]amino]-N-pyridin-4-ylbenzamide IUPAC Name: 3-[[2-tert-butyl-3-(2,3,4-trimethoxyphenyl)octanoyl]amino]-N-pyridin-4-ylbenzamide Traditional Name: 3-[[2-tert-butyl-3-(2,3,4-trimethoxyphenyl)octanoyl]amino]-N-(4-pyridyl)benzamide Formula: C33H43N3O5 MolecularWeight: 561.71162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C(=C(C=C1)OC)OC)OC)C(C(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=NC=C3)C(C)(C)C

Isomeric SMILES

CCCCCC(C1=C(C(=C(C=C1)OC)OC)OC)C(C(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=NC=C3)C(C)(C)C

InChI

InChI=1S/C33H43N3O5/c1-8-9-10-14-25(26-15-16-27(39-5)30(41-7)29(26)40-6)28(33(2,3)4)32(38)36-24-13-11-12-22(21-24)31(37)35-23-17-19-34-20-18-23/h11-13,15-21,25,28H,8-10,14H2,1-7H3,(H,36,38)(H,34,35,37)