(2-chloranyl-6-ethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 2,5-bis(chloranyl)benzoate

Systemtic Name: (2-chloranyl-6-ethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 2,5-bis(chloranyl)benzoate Openeye Name: [2-chloro-6-ethoxy-4-(morpholine-4-carbothioyl)phenyl] 2,5-dichlorobenzoate CAS Name: 2,5-dichlorobenzoic acid [2-chloro-6-ethoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-chloro-6-ethoxy-4-(morpholine-4-carbothioyl)phenyl] 2,5-dichlorobenzoate Traditional Name: 2,5-dichlorobenzoic acid [2-chloro-6-ethoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C20H18Cl3NO4S MolecularWeight: 474.78522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OC(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OC(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C20H18Cl3NO4S/c1-2-27-17-10-12(19(29)24-5-7-26-8-6-24)9-16(23)18(17)28-20(25)14-11-13(21)3-4-15(14)22/h3-4,9-11H,2,5-8H2,1H3