2-[4-[(E)-4-iodanylhex-2-en-3-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-4-iodanylhex-2-en-3-yl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(1E)-1-ethylidene-2-iodo-butyl]phenoxy]acetic acid CAS Name: 2-[4-[(E)-4-iodohex-2-en-3-yl]phenoxy]acetic acid IUPAC Name: 2-[4-[(E)-4-iodohex-2-en-3-yl]phenoxy]acetic acid Traditional Name: 2-[4-[(E)-1-(1-iodopropyl)prop-1-enyl]phenoxy]acetic acid Formula: C14H17IO3 MolecularWeight: 360.18745

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=CC)C1=CC=C(C=C1)OCC(=O)O)I

Isomeric SMILES

CCC(/C(=C/C)/C1=CC=C(C=C1)OCC(=O)O)I

InChI

InChI=1S/C14H17IO3/c1-3-12(13(15)4-2)10-5-7-11(8-6-10)18-9-14(16)17/h3,5-8,13H,4,9H2,1-2H3,(H,16,17)/b12-3+