[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 3-methylbut-2-enoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 3-methylbut-2-enoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [2-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [2-keto-2-(4-pyrrolidinosulfonylphenyl)ethyl] ester Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5S/c1-13(2)11-17(20)23-12-16(19)14-5-7-15(8-6-14)24(21,22)18-9-3-4-10-18/h5-8,11H,3-4,9-10,12H2,1-2H3