[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(4-bromophenyl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(4-bromophenyl)sulfonylamino]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 3-[(4-bromophenyl)sulfonylamino]benzoate CAS Name: 3-[(4-bromophenyl)sulfonylamino]benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(4-bromophenyl)sulfonylamino]benzoate Traditional Name: 3-(brosylamino)benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H20BrN3O6S MolecularWeight: 498.3476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H20BrN3O6S/c1-12(2)21-19(26)22-17(24)11-29-18(25)13-4-3-5-15(10-13)23-30(27,28)16-8-6-14(20)7-9-16/h3-10,12,23H,11H2,1-2H3,(H2,21,22,24,26)