[(2R,3S)-1-[(6-iodanyl-1,3-benzodioxol-5-yl)methyl]-5-oxidanylidene-2-phenylselanyl-pyrrolidin-3-yl] ethanoate

Systemtic Name: [(2R,3S)-1-[(6-iodanyl-1,3-benzodioxol-5-yl)methyl]-5-oxidanylidene-2-phenylselanyl-pyrrolidin-3-yl] ethanoate Openeye Name: [(2R,3S)-1-[(6-iodo-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-phenylselanyl-pyrrolidin-3-yl] acetate CAS Name: acetic acid [(2R,3S)-1-[(6-iodo-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-(phenylseleno)-3-pyrrolidinyl] ester IUPAC Name: [(2R,3S)-1-[(6-iodo-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-phenylselanylpyrrolidin-3-yl] acetate Traditional Name: acetic acid [(2R,3S)-1-[(6-iodo-1,3-benzodioxol-5-yl)methyl]-5-keto-2-(phenylseleno)pyrrolidin-3-yl] ester Formula: C20H18INO5Se MolecularWeight: 558.22509

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=O)N(C1[Se]C2=CC=CC=C2)CC3=CC4=C(C=C3I)OCO4

Isomeric SMILES

CC(=O)O[C@H]1CC(=O)N([C@@H]1[Se]C2=CC=CC=C2)CC3=CC4=C(C=C3I)OCO4

InChI

InChI=1S/C20H18INO5Se/c1-12(23)27-18-9-19(24)22(20(18)28-14-5-3-2-4-6-14)10-13-7-16-17(8-15(13)21)26-11-25-16/h2-8,18,20H,9-11H2,1H3/t18-,20+/m0/s1