[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl] 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl] 4-(methylsulfonylmethyl)benzoate Openeye Name: [2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [2-keto-2-(2-phenyl-1H-indol-3-yl)ethyl] ester Formula: C25H21NO5S MolecularWeight: 447.50294

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H21NO5S/c1-32(29,30)16-17-11-13-19(14-12-17)25(28)31-15-22(27)23-20-9-5-6-10-21(20)26-24(23)18-7-3-2-4-8-18/h2-14,26H,15-16H2,1H3