methyl (2S,3R,4R)-1-[2-(4-hydroxyphenyl)ethyl]-4-oxidanyl-5-oxidanylidene-2-propyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl (2S,3R,4R)-1-[2-(4-hydroxyphenyl)ethyl]-4-oxidanyl-5-oxidanylidene-2-propyl-pyrrolidine-3-carboxylate Openeye Name: methyl (2S,3R,4R)-4-hydroxy-1-[2-(4-hydroxyphenyl)ethyl]-5-oxo-2-propyl-pyrrolidine-3-carboxylate CAS Name: (2S,3R,4R)-4-hydroxy-1-[2-(4-hydroxyphenyl)ethyl]-5-oxo-2-propyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3R,4R)-4-hydroxy-1-[2-(4-hydroxyphenyl)ethyl]-5-oxo-2-propylpyrrolidine-3-carboxylate Traditional Name: (2S,3R,4R)-4-hydroxy-1-[2-(4-hydroxyphenyl)ethyl]-5-keto-2-propyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(C(=O)N1CCC2=CC=C(C=C2)O)O)C(=O)OC

Isomeric SMILES

CCC[C@H]1[C@H]([C@H](C(=O)N1CCC2=CC=C(C=C2)O)O)C(=O)OC

InChI

InChI=1S/C17H23NO5/c1-3-4-13-14(17(22)23-2)15(20)16(21)18(13)10-9-11-5-7-12(19)8-6-11/h5-8,13-15,19-20H,3-4,9-10H2,1-2H3/t13-,14+,15+/m0/s1