[(2R,3S)-5-acetyloxy-1-ethanoyl-2-(phenylmethoxymethyl)pyrrolidin-3-yl] benzoate

Systemtic Name: [(2R,3S)-5-acetyloxy-1-ethanoyl-2-(phenylmethoxymethyl)pyrrolidin-3-yl] benzoate Openeye Name: [(2R,3S)-5-acetoxy-1-acetyl-2-(benzyloxymethyl)pyrrolidin-3-yl] benzoate CAS Name: benzoic acid [(2R,3S)-1-acetyl-5-acetyloxy-2-(phenylmethoxymethyl)-3-pyrrolidinyl] ester IUPAC Name: [(2R,3S)-1-acetyl-5-acetyloxy-2-(phenylmethoxymethyl)pyrrolidin-3-yl] benzoate Traditional Name: benzoic acid [(2R,3S)-5-acetoxy-1-acetyl-2-(benzoxymethyl)pyrrolidin-3-yl] ester Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(C1COCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC(=O)N1[C@@H]([C@H](CC1OC(=O)C)OC(=O)C2=CC=CC=C2)COCC3=CC=CC=C3

InChI

InChI=1S/C23H25NO6/c1-16(25)24-20(15-28-14-18-9-5-3-6-10-18)21(13-22(24)29-17(2)26)30-23(27)19-11-7-4-8-12-19/h3-12,20-22H,13-15H2,1-2H3/t20-,21+,22?/m1/s1