3-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfonylbenzoic acid

Systemtic Name: 3-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfonylbenzoic acid Openeye Name: 3-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfonylbenzoic acid CAS Name: 3-[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]sulfonylbenzoic acid IUPAC Name: 3-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfonylbenzoic acid Traditional Name: 3-(2-keto-1-methyl-2-pyrrolidino-ethyl)sulfonylbenzoic acid Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H17NO5S/c1-10(13(16)15-7-2-3-8-15)21(19,20)12-6-4-5-11(9-12)14(17)18/h4-6,9-10H,2-3,7-8H2,1H3,(H,17,18)