[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 1-(phenylsulfonyl)pyrrolidine-2-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 1-(phenylsulfonyl)pyrrolidine-2-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 1-(benzenesulfonyl)pyrrolidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-pyrrolidinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 1-(benzenesulfonyl)pyrrolidine-2-carboxylate Traditional Name: 1-besylpyrrolidine-2-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C19H18BrNO5S MolecularWeight: 452.31892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrNO5S/c20-15-10-8-14(9-11-15)18(22)13-26-19(23)17-7-4-12-21(17)27(24,25)16-5-2-1-3-6-16/h1-3,5-6,8-11,17H,4,7,12-13H2