ethyl 1-tert-butyl-4-[[4-(4-chlorophenyl)sulfonyloxyphenyl]amino]-5-oxidanylidene-2H-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-tert-butyl-4-[[4-(4-chlorophenyl)sulfonyloxyphenyl]amino]-5-oxidanylidene-2H-pyrrole-3-carboxylate Openeye Name: ethyl 1-tert-butyl-4-[4-(4-chlorophenyl)sulfonyloxyanilino]-5-oxo-2H-pyrrole-3-carboxylate CAS Name: 1-tert-butyl-4-[4-(4-chlorophenyl)sulfonyloxyanilino]-5-oxo-2H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-tert-butyl-4-[4-(4-chlorophenyl)sulfonyloxyanilino]-5-oxo-2H-pyrrole-3-carboxylate Traditional Name: 1-tert-butyl-4-[4-(4-chlorophenyl)sulfonyloxyanilino]-5-keto-3-pyrroline-3-carboxylic acid ethyl ester Formula: C23H25ClN2O6S MolecularWeight: 492.9724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(C1)C(C)(C)C)NC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(C1)C(C)(C)C)NC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN2O6S/c1-5-31-22(28)19-14-26(23(2,3)4)21(27)20(19)25-16-8-10-17(11-9-16)32-33(29,30)18-12-6-15(24)7-13-18/h6-13,25H,5,14H2,1-4H3