[2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl] 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl] 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [2-(N-allylanilino)-2-oxo-ethyl] 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid [2-oxo-2-(N-prop-2-enylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-prop-2-enylanilino)ethyl] 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [2-(N-allylanilino)-2-keto-ethyl] ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC(=O)N(CC=C)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC(=O)N(CC=C)C2=CC=CC=C2

InChI

InChI=1S/C20H21NO5S/c1-4-12-21(16-8-6-5-7-9-16)19(22)14-26-20(23)18-13-17(27(3,24)25)11-10-15(18)2/h4-11,13H,1,12,14H2,2-3H3