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

Systemtic Name: N-[[4-tert-butyl-3-[3-(2,4-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-[[4-tert-butyl-3-[3-(2,4-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide CAS Name: N-[[4-tert-butyl-3-[[3-(2,4-dimethoxyphenyl)-1-oxooctyl]amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[[4-tert-butyl-3-[3-(2,4-dimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-[4-tert-butyl-3-[3-(2,4-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=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

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