tert-butyl 2-[(1S,2S,3S)-1,2,3-triacetyloxy-4-phenylmethoxy-butyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(1S,2S,3S)-1,2,3-triacetyloxy-4-phenylmethoxy-butyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(1S,2S,3S)-1,2,3-triacetoxy-4-benzyloxy-butyl]pyrrolidine-1-carboxylate CAS Name: 2-[(1S,2S,3S)-1,2,3-triacetyloxy-4-phenylmethoxybutyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1S,2S,3S)-1,2,3-triacetyloxy-4-phenylmethoxybutyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(1S,2S,3S)-1,2,3-triacetoxy-4-benzoxy-butyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C26H37NO9 MolecularWeight: 507.57328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(COCC1=CC=CC=C1)C(C(C2CCCN2C(=O)OC(C)(C)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)O[C@@H](COCC1=CC=CC=C1)[C@H]([C@H](C2CCCN2C(=O)OC(C)(C)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H37NO9/c1-17(28)33-22(16-32-15-20-11-8-7-9-12-20)24(35-19(3)30)23(34-18(2)29)21-13-10-14-27(21)25(31)36-26(4,5)6/h7-9,11-12,21-24H,10,13-16H2,1-6H3/t21?,22-,23-,24+/m0/s1