[4-[(E)-3-iodanyl-1-oxidanyl-prop-2-enyl]-2-methyl-piperidin-3-yl] ethanoate

Systemtic Name: [4-[(E)-3-iodanyl-1-oxidanyl-prop-2-enyl]-2-methyl-piperidin-3-yl] ethanoate Openeye Name: [4-[(E)-1-hydroxy-3-iodo-allyl]-2-methyl-3-piperidyl] acetate CAS Name: acetic acid [4-[(E)-1-hydroxy-3-iodoprop-2-enyl]-2-methyl-3-piperidinyl] ester IUPAC Name: [4-[(E)-1-hydroxy-3-iodoprop-2-enyl]-2-methylpiperidin-3-yl] acetate Traditional Name: acetic acid [4-[(E)-1-hydroxy-3-iodo-allyl]-2-methyl-3-piperidyl] ester Formula: C11H18INO3 MolecularWeight: 339.16999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CCN1)C(C=CI)O)OC(=O)C

Isomeric SMILES

CC1C(C(CCN1)C(/C=C/I)O)OC(=O)C

InChI

InChI=1S/C11H18INO3/c1-7-11(16-8(2)14)9(4-6-13-7)10(15)3-5-12/h3,5,7,9-11,13,15H,4,6H2,1-2H3/b5-3+