phenyl (2S,4R)-2-[(2,5-dimethoxyphenyl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: phenyl (2S,4R)-2-[(2,5-dimethoxyphenyl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: phenyl (2S,4R)-2-[(2,5-dimethoxyphenyl)carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-[(2,5-dimethoxyanilino)-oxomethyl]-4-hydroxy-1-pyrrolidinecarboxylic acid phenyl ester IUPAC Name: phenyl (2S,4R)-2-[(2,5-dimethoxyphenyl)carbamoyl]-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,4R)-2-[(2,5-dimethoxyphenyl)carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylic acid phenyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2CC(CN2C(=O)OC3=CC=CC=C3)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)[C@@H]2C[C@H](CN2C(=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C20H22N2O6/c1-26-15-8-9-18(27-2)16(11-15)21-19(24)17-10-13(23)12-22(17)20(25)28-14-6-4-3-5-7-14/h3-9,11,13,17,23H,10,12H2,1-2H3,(H,21,24)/t13-,17+/m1/s1