(2S,3S)-3-(4-chlorophenyl)-2-ethyl-4-morpholin-4-yl-4-oxidanylidene-butanoic acid

Systemtic Name: (2S,3S)-3-(4-chlorophenyl)-2-ethyl-4-morpholin-4-yl-4-oxidanylidene-butanoic acid Openeye Name: (2S,3S)-3-(4-chlorophenyl)-2-ethyl-4-morpholino-4-oxo-butanoic acid CAS Name: (2S,3S)-3-(4-chlorophenyl)-2-ethyl-4-(4-morpholinyl)-4-oxobutanoic acid IUPAC Name: (2S,3S)-3-(4-chlorophenyl)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid Traditional Name: (2S,3S)-3-(4-chlorophenyl)-2-ethyl-4-keto-4-morpholino-butyric acid Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=C(C=C1)Cl)C(=O)N2CCOCC2)C(=O)O

Isomeric SMILES

CC[C@@H]([C@@H](C1=CC=C(C=C1)Cl)C(=O)N2CCOCC2)C(=O)O

InChI

InChI=1S/C16H20ClNO4/c1-2-13(16(20)21)14(11-3-5-12(17)6-4-11)15(19)18-7-9-22-10-8-18/h3-6,13-14H,2,7-10H2,1H3,(H,20,21)/t13-,14+/m0/s1