N-[[4-tert-butyl-3-[3-(2,6-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: N-[[4-tert-butyl-3-[3-(2,6-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-[[4-tert-butyl-3-[3-(2,6-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide CAS Name: N-[[4-tert-butyl-3-[[3-(2,6-dimethoxyphenyl)-1-oxooctyl]amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[[4-tert-butyl-3-[3-(2,6-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-[4-tert-butyl-3-[3-(2,6-dimethoxyphenyl)octanoylamino]benzyl]nicotinamide Formula: C33H43N3O4 MolecularWeight: 545.71222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CNC(=O)C2=CN=CC=C2)C(C)(C)C)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CNC(=O)C2=CN=CC=C2)C(C)(C)C)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C33H43N3O4/c1-7-8-9-12-24(31-28(39-5)14-10-15-29(31)40-6)20-30(37)36-27-19-23(16-17-26(27)33(2,3)4)21-35-32(38)25-13-11-18-34-22-25/h10-11,13-19,22,24H,7-9,12,20-21H2,1-6H3,(H,35,38)(H,36,37)