N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-chloranyl-pyridine-3-carboxamide Openeye Name: N-[4-[2,4-bis(1,1-dimethylpropoxy)phenyl]butyl]-2-chloro-pyridine-3-carboxamide CAS Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-chloro-3-pyridinecarboxamide IUPAC Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-chloropyridine-3-carboxamide Traditional Name: 2-chloro-N-[4-(2,4-ditert-amyloxyphenyl)butyl]nicotinamide Formula: C26H37ClN2O3 MolecularWeight: 461.03658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNC(=O)C2=C(N=CC=C2)Cl)OC(C)(C)CC

Isomeric SMILES

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNC(=O)C2=C(N=CC=C2)Cl)OC(C)(C)CC

InChI

InChI=1S/C26H37ClN2O3/c1-7-25(3,4)31-20-15-14-19(22(18-20)32-26(5,6)8-2)12-9-10-16-29-24(30)21-13-11-17-28-23(21)27/h11,13-15,17-18H,7-10,12,16H2,1-6H3,(H,29,30)