ethyl 4-[2-(2,4-dichlorophenyl)ethanoyl]thiomorpholin-4-ium-4-carboxylate

Systemtic Name: ethyl 4-[2-(2,4-dichlorophenyl)ethanoyl]thiomorpholin-4-ium-4-carboxylate Openeye Name: ethyl 4-[2-(2,4-dichlorophenyl)acetyl]thiomorpholin-4-ium-4-carboxylate CAS Name: 4-[2-(2,4-dichlorophenyl)-1-oxoethyl]-4-thiomorpholin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2,4-dichlorophenyl)acetyl]thiomorpholin-4-ium-4-carboxylate Traditional Name: 4-[2-(2,4-dichlorophenyl)acetyl]thiomorpholin-4-ium-4-carboxylic acid ethyl ester Formula: C15H18Cl2NO3S+ MolecularWeight: 363.27932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1(CCSCC1)C(=O)CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)[N+]1(CCSCC1)C(=O)CC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H18Cl2NO3S/c1-2-21-15(20)18(5-7-22-8-6-18)14(19)9-11-3-4-12(16)10-13(11)17/h3-4,10H,2,5-9H2,1H3/q+1