[2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 2-(2-chloranylphenoxy)ethanoate

Systemtic Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 2-(2-chloranylphenoxy)ethanoate Openeye Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxo-ethyl] 2-(2-chlorophenoxy)acetate CAS Name: 2-(2-chlorophenoxy)acetic acid [2-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxoethyl] 2-(2-chlorophenoxy)acetate Traditional Name: 2-(2-chlorophenoxy)acetic acid [2-[4-(isovalerylamino)phenyl]-2-keto-ethyl] ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)COC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)COC2=CC=CC=C2Cl

InChI

InChI=1S/C21H22ClNO5/c1-14(2)11-20(25)23-16-9-7-15(8-10-16)18(24)12-28-21(26)13-27-19-6-4-3-5-17(19)22/h3-10,14H,11-13H2,1-2H3,(H,23,25)