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

Systemtic Name: methyl 2-[4-[2,3-bis(oxidanyl)pyrrolidin-1-yl]-3-chloranyl-phenyl]propanoate Openeye Name: methyl 2-[3-chloro-4-(2,3-dihydroxypyrrolidin-1-yl)phenyl]propanoate CAS Name: 2-[3-chloro-4-(2,3-dihydroxy-1-pyrrolidinyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-chloro-4-(2,3-dihydroxypyrrolidin-1-yl)phenyl]propanoate Traditional Name: 2-[3-chloro-4-(2,3-dihydroxypyrrolidino)phenyl]propionic acid methyl ester Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2CCC(C2O)O)Cl)C(=O)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)N2CCC(C2O)O)Cl)C(=O)OC

InChI

InChI=1S/C14H18ClNO4/c1-8(14(19)20-2)9-3-4-11(10(15)7-9)16-6-5-12(17)13(16)18/h3-4,7-8,12-13,17-18H,5-6H2,1-2H3