2-[4-[3,4-bis(oxidanyl)pyrrolidin-1-yl]-3-chloranyl-phenyl]propanoic acid

Systemtic Name: 2-[4-[3,4-bis(oxidanyl)pyrrolidin-1-yl]-3-chloranyl-phenyl]propanoic acid Openeye Name: 2-[3-chloro-4-(3,4-dihydroxypyrrolidin-1-yl)phenyl]propanoic acid CAS Name: 2-[3-chloro-4-(3,4-dihydroxy-1-pyrrolidinyl)phenyl]propanoic acid IUPAC Name: 2-[3-chloro-4-(3,4-dihydroxypyrrolidin-1-yl)phenyl]propanoic acid Traditional Name: 2-[3-chloro-4-(3,4-dihydroxypyrrolidino)phenyl]propionic acid Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2CC(C(C2)O)O)Cl)C(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)N2CC(C(C2)O)O)Cl)C(=O)O

InChI

InChI=1S/C13H16ClNO4/c1-7(13(18)19)8-2-3-10(9(14)4-8)15-5-11(16)12(17)6-15/h2-4,7,11-12,16-17H,5-6H2,1H3,(H,18,19)