[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(2,4-dichlorophenyl)-2-oxo-ethyl] 2,3-dimethoxy-5-morpholinosulfonyl-benzoate CAS Name: 2,3-dimethoxy-5-(4-morpholinylsulfonyl)benzoic acid [2-(2,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-2-oxoethyl] 2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2,3-dimethoxy-5-morpholinosulfonyl-benzoic acid [2-(2,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C21H21Cl2NO8S MolecularWeight: 518.36434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)C3=C(C=C(C=C3)Cl)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)C3=C(C=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C21H21Cl2NO8S/c1-29-19-11-14(33(27,28)24-5-7-31-8-6-24)10-16(20(19)30-2)21(26)32-12-18(25)15-4-3-13(22)9-17(15)23/h3-4,9-11H,5-8,12H2,1-2H3