[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(benzylsulfamoyl)benzoate CAS Name: 3-[(phenylmethyl)sulfamoyl]benzoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(benzylsulfamoyl)benzoate Traditional Name: 3-(benzylsulfamoyl)benzoic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)C)C

InChI

InChI=1S/C25H25NO5S/c1-17-12-19(3)23(13-18(17)2)24(27)16-31-25(28)21-10-7-11-22(14-21)32(29,30)26-15-20-8-5-4-6-9-20/h4-14,26H,15-16H2,1-3H3