[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl] 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCNC(=O)COC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCNC(=O)COC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C18H18ClNO4S/c19-14-4-1-3-13(11-14)8-9-20-17(22)12-24-18(23)7-6-15(21)16-5-2-10-25-16/h1-5,10-11H,6-9,12H2,(H,20,22)