[(3S)-2-oxidanylideneoxolan-3-yl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C16H19NO7S MolecularWeight: 369.38956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2CCOC2=O)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O[C@H]2CCOC2=O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H19NO7S/c1-22-12-5-4-11(15(18)24-13-6-9-23-16(13)19)10-14(12)25(20,21)17-7-2-3-8-17/h4-5,10,13H,2-3,6-9H2,1H3/t13-/m0/s1