[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C(C)(C)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C(C)(C)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO5/c1-4-19(25)23-16-9-5-14(6-10-16)18(24)13-27-20(26)21(2,3)28-17-11-7-15(22)8-12-17/h5-12H,4,13H2,1-3H3,(H,23,25)