2-[(3R,5S)-5-(acetamidomethyl)-1-(2-acetyloxyethyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(3R,5S)-5-(acetamidomethyl)-1-(2-acetyloxyethyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[(3R,5S)-5-(acetamidomethyl)-1-(2-acetoxyethyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[(3R,5S)-5-(acetamidomethyl)-1-(2-acetyloxyethyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[(3R,5S)-5-(acetamidomethyl)-1-(2-acetyloxyethyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[(3R,5S)-5-(acetamidomethyl)-1-(2-acetoxyethyl)pyrrolidin-3-yl]acetic acid Formula: C13H22N2O5 MolecularWeight: 286.32418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CC(CN1CCOC(=O)C)CC(=O)O

Isomeric SMILES

CC(=O)NC[C@@H]1C[C@@H](CN1CCOC(=O)C)CC(=O)O

InChI

InChI=1S/C13H22N2O5/c1-9(16)14-7-12-5-11(6-13(18)19)8-15(12)3-4-20-10(2)17/h11-12H,3-8H2,1-2H3,(H,14,16)(H,18,19)/t11-,12+/m1/s1