[1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 3-methylsulfonylbenzoate

Systemtic Name: [1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 3-methylsulfonylbenzoate Openeye Name: [1-methyl-2-oxo-2-(2,4,6-trimethylanilino)ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (2-keto-2-mesidino-1-methyl-ethyl) ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C

InChI

InChI=1S/C20H23NO5S/c1-12-9-13(2)18(14(3)10-12)21-19(22)15(4)26-20(23)16-7-6-8-17(11-16)27(5,24)25/h6-11,15H,1-5H3,(H,21,22)