[4-[(E)-4-iodanylbut-3-enoxy]-1-methyl-piperidin-3-yl] ethanoate

Systemtic Name: [4-[(E)-4-iodanylbut-3-enoxy]-1-methyl-piperidin-3-yl] ethanoate Openeye Name: [4-[(E)-4-iodobut-3-enoxy]-1-methyl-3-piperidyl] acetate CAS Name: acetic acid [4-[(E)-4-iodobut-3-enoxy]-1-methyl-3-piperidinyl] ester IUPAC Name: [4-[(E)-4-iodobut-3-enoxy]-1-methylpiperidin-3-yl] acetate Traditional Name: acetic acid [4-[(E)-4-iodobut-3-enoxy]-1-methyl-3-piperidyl] ester Formula: C12H20INO3 MolecularWeight: 353.19657

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CN(CCC1OCCC=CI)C

Isomeric SMILES

CC(=O)OC1CN(CCC1OCC/C=C/I)C

InChI

InChI=1S/C12H20INO3/c1-10(15)17-12-9-14(2)7-5-11(12)16-8-4-3-6-13/h3,6,11-12H,4-5,7-9H2,1-2H3/b6-3+