4-(4-chloranyl-2-methyl-phenoxy)-N-[4-(2-methylpropanoylamino)phenyl]butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-[4-(2-methylpropanoylamino)phenyl]butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-[4-(2-methylpropanoylamino)phenyl]butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-[4-(2-methylpropanoylamino)phenyl]butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[4-(isobutyrylamino)phenyl]butyramide Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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