N-(3-azanyl-4-chloranyl-phenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide

Systemtic Name: N-(3-azanyl-4-chloranyl-phenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide Openeye Name: N-(3-amino-4-chloro-phenyl)-4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanamide CAS Name: N-(3-amino-4-chlorophenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide IUPAC Name: N-(3-amino-4-chlorophenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide Traditional Name: N-(3-amino-4-chloro-phenyl)-4-(2,4-ditert-amylphenoxy)butyramide Formula: C26H37ClN2O2 MolecularWeight: 445.03718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)N)C(C)(C)CC

InChI

InChI=1S/C26H37ClN2O2/c1-7-25(3,4)18-11-14-23(20(16-18)26(5,6)8-2)31-15-9-10-24(30)29-19-12-13-21(27)22(28)17-19/h11-14,16-17H,7-10,15,28H2,1-6H3,(H,29,30)