[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(2,4,6-trimethylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-mesitylsulfonylpyrrolidine-2-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1CCCN1S(=O)(=O)C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1CCCN1S(=O)(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C20H30N2O5S/c1-6-16(5)21-18(23)12-27-20(24)17-8-7-9-22(17)28(25,26)19-14(3)10-13(2)11-15(19)4/h10-11,16-17H,6-9,12H2,1-5H3,(H,21,23)