[6-(methylsulfonylamino)-2-oxidanyl-3-(phenylcarbonyl)indol-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [6-(methylsulfonylamino)-2-oxidanyl-3-(phenylcarbonyl)indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [3-benzoyl-2-hydroxy-6-(methanesulfonamido)indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-benzoyl-2-hydroxy-6-(methanesulfonamido)-1-indolyl] ester IUPAC Name: [3-benzoyl-2-hydroxy-6-(methanesulfonamido)indol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-benzoyl-2-hydroxy-6-(methanesulfonamido)indol-1-yl] ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NS(=O)(=O)C)C(=C1O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NS(=O)(=O)C)C(=C1O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O6S/c1-21(2,3)20(26)29-23-16-12-14(22-30(4,27)28)10-11-15(16)17(19(23)25)18(24)13-8-6-5-7-9-13/h5-12,22,25H,1-4H3