[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 3-methylbut-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 3-methylbut-2-enoate Openeye Name: [2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl] ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C

Isomeric SMILES

CC(=CC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C

InChI

InChI=1S/C17H22N2O5S/c1-13(2)10-17(21)24-12-16(20)18-14-6-5-7-15(11-14)25(22,23)19-8-3-4-9-19/h5-7,10-11H,3-4,8-9,12H2,1-2H3,(H,18,20)