trimethyl (3S,5R)-5-phenethylpyrrolidine-2,2,3-tricarboxylate

Systemtic Name: trimethyl (3S,5R)-5-phenethylpyrrolidine-2,2,3-tricarboxylate Openeye Name: trimethyl (3S,5R)-5-phenethylpyrrolidine-2,2,3-tricarboxylate CAS Name: (3S,5R)-5-phenethylpyrrolidine-2,2,3-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (3S,5R)-5-phenethylpyrrolidine-2,2,3-tricarboxylate Traditional Name: (3S,5R)-5-phenethylpyrrolidine-2,2,3-tricarboxylic acid trimethyl ester Formula: C18H23NO6 MolecularWeight: 349.37832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(NC1(C(=O)OC)C(=O)OC)CCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H]1C[C@H](NC1(C(=O)OC)C(=O)OC)CCC2=CC=CC=C2

InChI

InChI=1S/C18H23NO6/c1-23-15(20)14-11-13(10-9-12-7-5-4-6-8-12)19-18(14,16(21)24-2)17(22)25-3/h4-8,13-14,19H,9-11H2,1-3H3/t13-,14-/m1/s1