[(2S,5R)-1-ethanoyl-5-(4-iodanylpyridin-3-yl)pyrrolidin-2-yl]methyl ethanoate

Systemtic Name: [(2S,5R)-1-ethanoyl-5-(4-iodanylpyridin-3-yl)pyrrolidin-2-yl]methyl ethanoate Openeye Name: [(2S,5R)-1-acetyl-5-(4-iodo-3-pyridyl)pyrrolidin-2-yl]methyl acetate CAS Name: acetic acid [(2S,5R)-1-acetyl-5-(4-iodo-3-pyridinyl)-2-pyrrolidinyl]methyl ester IUPAC Name: [(2S,5R)-1-acetyl-5-(4-iodopyridin-3-yl)pyrrolidin-2-yl]methyl acetate Traditional Name: acetic acid [(2S,5R)-1-acetyl-5-(4-iodo-3-pyridyl)pyrrolidin-2-yl]methyl ester Formula: C14H17IN2O3 MolecularWeight: 388.20085

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CCC1C2=C(C=CN=C2)I)COC(=O)C

Isomeric SMILES

CC(=O)N1[C@@H](CC[C@@H]1C2=C(C=CN=C2)I)COC(=O)C

InChI

InChI=1S/C14H17IN2O3/c1-9(18)17-11(8-20-10(2)19)3-4-14(17)12-7-16-6-5-13(12)15/h5-7,11,14H,3-4,8H2,1-2H3/t11-,14+/m0/s1