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

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 4-methoxy-3-sulfamoyl-benzoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 4-methoxy-3-sulfamoyl-benzoate CAS Name: 4-methoxy-3-sulfamoylbenzoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 4-methoxy-3-sulfamoylbenzoate Traditional Name: 4-methoxy-3-sulfamoyl-benzoic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N)C)C

InChI

InChI=1S/C19H21NO6S/c1-11-7-13(3)15(8-12(11)2)16(21)10-26-19(22)14-5-6-17(25-4)18(9-14)27(20,23)24/h5-9H,10H2,1-4H3,(H2,20,23,24)