N-[3,5-bis(chloranyl)-4-methyl-2-oxidanyl-phenyl]-2-(2,4-dipentylphenoxy)butanamide

Systemtic Name: N-[3,5-bis(chloranyl)-4-methyl-2-oxidanyl-phenyl]-2-(2,4-dipentylphenoxy)butanamide Openeye Name: N-(3,5-dichloro-2-hydroxy-4-methyl-phenyl)-2-(2,4-dipentylphenoxy)butanamide CAS Name: N-(3,5-dichloro-2-hydroxy-4-methylphenyl)-2-(2,4-dipentylphenoxy)butanamide IUPAC Name: N-(3,5-dichloro-2-hydroxy-4-methylphenyl)-2-(2,4-dipentylphenoxy)butanamide Traditional Name: 2-(2,4-diamylphenoxy)-N-(3,5-dichloro-2-hydroxy-4-methyl-phenyl)butyramide Formula: C27H37Cl2NO3 MolecularWeight: 494.49358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OC(CC)C(=O)NC2=CC(=C(C(=C2O)Cl)C)Cl)CCCCC

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OC(CC)C(=O)NC2=CC(=C(C(=C2O)Cl)C)Cl)CCCCC

InChI

InChI=1S/C27H37Cl2NO3/c1-5-8-10-12-19-14-15-24(20(16-19)13-11-9-6-2)33-23(7-3)27(32)30-22-17-21(28)18(4)25(29)26(22)31/h14-17,23,31H,5-13H2,1-4H3,(H,30,32)