tetradecyl 3-[[3,5-ditert-butyl-2-[(3-chloranyl-2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)sulfamoyl]phenyl]carbonylamino]benzoate

Systemtic Name: tetradecyl 3-[[3,5-ditert-butyl-2-[(3-chloranyl-2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)sulfamoyl]phenyl]carbonylamino]benzoate Openeye Name: tetradecyl 3-[[3,5-ditert-butyl-2-[(3-chloro-4-hydroxy-5-isopropyl-2-methyl-phenyl)sulfamoyl]benzoyl]amino]benzoate CAS Name: 3-[[[3,5-ditert-butyl-2-[(3-chloro-4-hydroxy-2-methyl-5-propan-2-ylphenyl)sulfamoyl]phenyl]-oxomethyl]amino]benzoic acid tetradecyl ester IUPAC Name: tetradecyl 3-[[3,5-ditert-butyl-2-[(3-chloro-4-hydroxy-2-methyl-5-propan-2-ylphenyl)sulfamoyl]benzoyl]amino]benzoate Traditional Name: 3-[[3,5-ditert-butyl-2-[(3-chloro-4-hydroxy-5-isopropyl-2-methyl-phenyl)sulfamoyl]benzoyl]amino]benzoic acid myristyl ester Formula: C46H67ClN2O6S MolecularWeight: 811.55198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2S(=O)(=O)NC3=C(C(=C(C(=C3)C(C)C)O)Cl)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2S(=O)(=O)NC3=C(C(=C(C(=C3)C(C)C)O)Cl)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C46H67ClN2O6S/c1-11-12-13-14-15-16-17-18-19-20-21-22-26-55-44(52)33-24-23-25-35(27-33)48-43(51)37-28-34(45(5,6)7)29-38(46(8,9)10)42(37)56(53,54)49-39-30-36(31(2)3)41(50)40(47)32(39)4/h23-25,27-31,49-50H,11-22,26H2,1-10H3,(H,48,51)