N-[[4-tert-butyl-3-[3-(3,4,5-trimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: N-[[4-tert-butyl-3-[3-(3,4,5-trimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-[[4-tert-butyl-3-[3-(3,4,5-trimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide CAS Name: N-[[4-tert-butyl-3-[[1-oxo-3-(3,4,5-trimethoxyphenyl)octyl]amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[[4-tert-butyl-3-[3-(3,4,5-trimethoxyphenyl)octanoylamino]phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-[4-tert-butyl-3-[3-(3,4,5-trimethoxyphenyl)octanoylamino]benzyl]nicotinamide Formula: C34H45N3O5 MolecularWeight: 575.7382

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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=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C34H45N3O5/c1-8-9-10-12-24(26-18-29(40-5)32(42-7)30(19-26)41-6)20-31(38)37-28-17-23(14-15-27(28)34(2,3)4)21-36-33(39)25-13-11-16-35-22-25/h11,13-19,22,24H,8-10,12,20-21H2,1-7H3,(H,36,39)(H,37,38)