ethyl 3,5,6-tris(chloranyl)-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-pyridine-2-carboxylate

Systemtic Name: ethyl 3,5,6-tris(chloranyl)-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-pyridine-2-carboxylate Openeye Name: ethyl 3,5,6-trichloro-4-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-pyridine-2-carboxylate CAS Name: 3,5,6-trichloro-4-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-2-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3,5,6-trichloro-4-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpyridine-2-carboxylate Traditional Name: 3,5,6-trichloro-4-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]picolinic acid ethyl ester Formula: C22H26Cl3NO3S MolecularWeight: 490.87074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=C(C(=C1Cl)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=NC(=C(C(=C1Cl)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)Cl)Cl

InChI

InChI=1S/C22H26Cl3NO3S/c1-8-29-20(28)16-14(23)18(15(24)19(25)26-16)30-11-9-12(21(2,3)4)17(27)13(10-11)22(5,6)7/h9-10,27H,8H2,1-7H3