methyl (2S,5R)-5-(4-hydroxyphenyl)-1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,5R)-5-(4-hydroxyphenyl)-1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,5R)-1-[2-(benzyloxycarbonylamino)acetyl]-5-(4-hydroxyphenyl)pyrrolidine-2-carboxylate CAS Name: (2S,5R)-5-(4-hydroxyphenyl)-1-[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,5R)-5-(4-hydroxyphenyl)-1-[2-(phenylmethoxycarbonylamino)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S,5R)-1-[2-(benzyloxycarbonylamino)acetyl]-5-(4-hydroxyphenyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(N1C(=O)CNC(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)O

Isomeric SMILES

COC(=O)[C@@H]1CC[C@@H](N1C(=O)CNC(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)O

InChI

InChI=1S/C22H24N2O6/c1-29-21(27)19-12-11-18(16-7-9-17(25)10-8-16)24(19)20(26)13-23-22(28)30-14-15-5-3-2-4-6-15/h2-10,18-19,25H,11-14H2,1H3,(H,23,28)/t18-,19+/m1/s1