N-[2-chloranyl-5-[4-(2,4-dimethylphenoxy)butanoylamino]phenyl]-4,4-dimethyl-3-oxidanylidene-pentanamide

Systemtic Name: N-[2-chloranyl-5-[4-(2,4-dimethylphenoxy)butanoylamino]phenyl]-4,4-dimethyl-3-oxidanylidene-pentanamide Openeye Name: N-[2-chloro-5-[4-(2,4-dimethylphenoxy)butanoylamino]phenyl]-4,4-dimethyl-3-oxo-pentanamide CAS Name: N-[2-chloro-5-[[4-(2,4-dimethylphenoxy)-1-oxobutyl]amino]phenyl]-4,4-dimethyl-3-oxopentanamide IUPAC Name: N-[2-chloro-5-[4-(2,4-dimethylphenoxy)butanoylamino]phenyl]-4,4-dimethyl-3-oxopentanamide Traditional Name: N-[2-chloro-5-[4-(2,4-dimethylphenoxy)butanoylamino]phenyl]-3-keto-4,4-dimethyl-valeramide Formula: C25H31ClN2O4 MolecularWeight: 458.97764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CC(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CC(=O)C(C)(C)C)C

InChI

InChI=1S/C25H31ClN2O4/c1-16-8-11-21(17(2)13-16)32-12-6-7-23(30)27-18-9-10-19(26)20(14-18)28-24(31)15-22(29)25(3,4)5/h8-11,13-14H,6-7,12,15H2,1-5H3,(H,27,30)(H,28,31)