ethyl 2-[[2-chloranyl-4-(dimethylamino)phenyl]methyl]-5-oxidanyl-3-oxidanylidene-pentanoate

Systemtic Name: ethyl 2-[[2-chloranyl-4-(dimethylamino)phenyl]methyl]-5-oxidanyl-3-oxidanylidene-pentanoate Openeye Name: ethyl 2-[[2-chloro-4-(dimethylamino)phenyl]methyl]-5-hydroxy-3-oxo-pentanoate CAS Name: 2-[[2-chloro-4-(dimethylamino)phenyl]methyl]-5-hydroxy-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-chloro-4-(dimethylamino)phenyl]methyl]-5-hydroxy-3-oxopentanoate Traditional Name: 2-[2-chloro-4-(dimethylamino)benzyl]-5-hydroxy-3-keto-valeric acid ethyl ester Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=C(C=C1)N(C)C)Cl)C(=O)CCO

Isomeric SMILES

CCOC(=O)C(CC1=C(C=C(C=C1)N(C)C)Cl)C(=O)CCO

InChI

InChI=1S/C16H22ClNO4/c1-4-22-16(21)13(15(20)7-8-19)9-11-5-6-12(18(2)3)10-14(11)17/h5-6,10,13,19H,4,7-9H2,1-3H3