2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(5-chloranyl-4-nitro-2-oxidanyl-phenyl)butanamide

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(5-chloranyl-4-nitro-2-oxidanyl-phenyl)butanamide Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-(5-chloro-2-hydroxy-4-nitro-phenyl)butanamide CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(5-chloro-2-hydroxy-4-nitrophenyl)butanamide IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(5-chloro-2-hydroxy-4-nitrophenyl)butanamide Traditional Name: N-(5-chloro-2-hydroxy-4-nitro-phenyl)-2-(2,4-ditert-amylphenoxy)butyramide Formula: C26H35ClN2O5 MolecularWeight: 491.0195

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1O)[N+](=O)[O-])Cl)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1O)[N+](=O)[O-])Cl)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C26H35ClN2O5/c1-8-22(24(31)28-19-14-18(27)20(29(32)33)15-21(19)30)34-23-12-11-16(25(4,5)9-2)13-17(23)26(6,7)10-3/h11-15,22,30H,8-10H2,1-7H3,(H,28,31)