[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 3-(4-acetamidophenyl)sulfonylpropanoate

Systemtic Name: [2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 3-(4-acetamidophenyl)sulfonylpropanoate Openeye Name: [2-(2,4-dichloroanilino)-2-oxo-ethyl] 3-(4-acetamidophenyl)sulfonylpropanoate CAS Name: 3-(4-acetamidophenyl)sulfonylpropanoic acid [2-(2,4-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichloroanilino)-2-oxoethyl] 3-(4-acetamidophenyl)sulfonylpropanoate Traditional Name: 3-(4-acetamidophenyl)sulfonylpropionic acid [2-(2,4-dichloroanilino)-2-keto-ethyl] ester Formula: C19H18Cl2N2O6S MolecularWeight: 473.32702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H18Cl2N2O6S/c1-12(24)22-14-3-5-15(6-4-14)30(27,28)9-8-19(26)29-11-18(25)23-17-7-2-13(20)10-16(17)21/h2-7,10H,8-9,11H2,1H3,(H,22,24)(H,23,25)