(2,2-dimethyl-3-oxidanyl-propyl) (3S,5R)-1-methoxy-5-(4-methoxyphenyl)pyrrolidine-3-carboxylate

Systemtic Name: (2,2-dimethyl-3-oxidanyl-propyl) (3S,5R)-1-methoxy-5-(4-methoxyphenyl)pyrrolidine-3-carboxylate Openeye Name: (3-hydroxy-2,2-dimethyl-propyl) (3S,5R)-1-methoxy-5-(4-methoxyphenyl)pyrrolidine-3-carboxylate CAS Name: (3S,5R)-1-methoxy-5-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid (3-hydroxy-2,2-dimethylpropyl) ester IUPAC Name: (3-hydroxy-2,2-dimethylpropyl) (3S,5R)-1-methoxy-5-(4-methoxyphenyl)pyrrolidine-3-carboxylate Traditional Name: (3S,5R)-1-methoxy-5-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid (3-hydroxy-2,2-dimethyl-propyl) ester Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)COC(=O)C1CC(N(C1)OC)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(CO)COC(=O)[C@H]1C[C@@H](N(C1)OC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H27NO5/c1-18(2,11-20)12-24-17(21)14-9-16(19(10-14)23-4)13-5-7-15(22-3)8-6-13/h5-8,14,16,20H,9-12H2,1-4H3/t14-,16+/m0/s1