N-[5-(butanoylamino)-2-chloranyl-phenyl]-2-(3-methylphenoxy)butanamide

Systemtic Name: N-[5-(butanoylamino)-2-chloranyl-phenyl]-2-(3-methylphenoxy)butanamide Openeye Name: N-[5-(butanoylamino)-2-chloro-phenyl]-2-(3-methylphenoxy)butanamide CAS Name: N-[2-chloro-5-(1-oxobutylamino)phenyl]-2-(3-methylphenoxy)butanamide IUPAC Name: N-[5-(butanoylamino)-2-chlorophenyl]-2-(3-methylphenoxy)butanamide Traditional Name: N-(5-butyramido-2-chloro-phenyl)-2-(3-methylphenoxy)butyramide Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(CC)OC2=CC=CC(=C2)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(CC)OC2=CC=CC(=C2)C

InChI

InChI=1S/C21H25ClN2O3/c1-4-7-20(25)23-15-10-11-17(22)18(13-15)24-21(26)19(5-2)27-16-9-6-8-14(3)12-16/h6,8-13,19H,4-5,7H2,1-3H3,(H,23,25)(H,24,26)