ethyl 4-[4-chloranyl-2-(2-phenylethanoylamino)phenyl]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 4-[4-chloranyl-2-(2-phenylethanoylamino)phenyl]-5-oxidanylidene-pentanoate Openeye Name: ethyl 4-[4-chloro-2-[(2-phenylacetyl)amino]phenyl]-5-oxo-pentanoate CAS Name: 4-[4-chloro-2-[(1-oxo-2-phenylethyl)amino]phenyl]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 4-[4-chloro-2-[(2-phenylacetyl)amino]phenyl]-5-oxopentanoate Traditional Name: 4-[4-chloro-2-[(2-phenylacetyl)amino]phenyl]-5-keto-valeric acid ethyl ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C=O)C1=C(C=C(C=C1)Cl)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCC(C=O)C1=C(C=C(C=C1)Cl)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H22ClNO4/c1-2-27-21(26)11-8-16(14-24)18-10-9-17(22)13-19(18)23-20(25)12-15-6-4-3-5-7-15/h3-7,9-10,13-14,16H,2,8,11-12H2,1H3,(H,23,25)