2-[(3-fluorophenyl)sulfonylamino]-3-[4-(3-oxidanylpyrrolidin-2-yl)carbonylphenyl]propanoic acid

Systemtic Name: 2-[(3-fluorophenyl)sulfonylamino]-3-[4-(3-oxidanylpyrrolidin-2-yl)carbonylphenyl]propanoic acid Openeye Name: 2-[(3-fluorophenyl)sulfonylamino]-3-[4-(3-hydroxypyrrolidine-2-carbonyl)phenyl]propanoic acid CAS Name: 2-[(3-fluorophenyl)sulfonylamino]-3-[4-[(3-hydroxy-2-pyrrolidinyl)-oxomethyl]phenyl]propanoic acid IUPAC Name: 2-[(3-fluorophenyl)sulfonylamino]-3-[4-(3-hydroxypyrrolidine-2-carbonyl)phenyl]propanoic acid Traditional Name: 2-[(3-fluorophenyl)sulfonylamino]-3-[4-(3-hydroxyprolyl)phenyl]propionic acid Formula: C20H21FN2O6S MolecularWeight: 436.453943

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C1O)C(=O)C2=CC=C(C=C2)CC(C(=O)O)NS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1CNC(C1O)C(=O)C2=CC=C(C=C2)CC(C(=O)O)NS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C20H21FN2O6S/c21-14-2-1-3-15(11-14)30(28,29)23-16(20(26)27)10-12-4-6-13(7-5-12)19(25)18-17(24)8-9-22-18/h1-7,11,16-18,22-24H,8-10H2,(H,26,27)