[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2,3,4,5,6-pentamethylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2,3,4,5,6-pentamethylbenzoate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2,3,4,5,6-pentamethylbenzoate CAS Name: 2,3,4,5,6-pentamethylbenzoic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2,3,4,5,6-pentamethylbenzoate Traditional Name: 2,3,4,5,6-pentamethylbenzoic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C)C

InChI

InChI=1S/C21H26N2O5S/c1-12-13(2)15(4)20(16(5)14(12)3)21(25)28-11-19(24)23-10-17-6-8-18(9-7-17)29(22,26)27/h6-9H,10-11H2,1-5H3,(H,23,24)(H2,22,26,27)