[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] (2R)-2-phenoxypropanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] (2R)-2-phenoxypropanoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] (2R)-2-phenoxypropanoate CAS Name: (2R)-2-phenoxypropanoic acid [2-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] (2R)-2-phenoxypropanoate Traditional Name: (2R)-2-phenoxypropionic acid [2-keto-2-(4-pyrrolidinosulfonylphenyl)ethyl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC3=CC=CC=C3

InChI

InChI=1S/C21H23NO6S/c1-16(28-18-7-3-2-4-8-18)21(24)27-15-20(23)17-9-11-19(12-10-17)29(25,26)22-13-5-6-14-22/h2-4,7-12,16H,5-6,13-15H2,1H3/t16-/m1/s1