methyl 2-[(E)-1-chloranyl-2-iodanyl-1-phenyl-hept-1-en-3-yl]oxyethanoate

Systemtic Name: methyl 2-[(E)-1-chloranyl-2-iodanyl-1-phenyl-hept-1-en-3-yl]oxyethanoate Openeye Name: methyl 2-[1-[(E)-2-chloro-1-iodo-2-phenyl-vinyl]pentoxy]acetate CAS Name: 2-[(E)-1-chloro-2-iodo-1-phenylhept-1-en-3-yl]oxyacetic acid methyl ester IUPAC Name: methyl 2-[(E)-1-chloro-2-iodo-1-phenylhept-1-en-3-yl]oxyacetate Traditional Name: 2-[(E)-1-butyl-3-chloro-2-iodo-3-phenyl-allyloxy]acetic acid methyl ester Formula: C16H20ClIO3 MolecularWeight: 422.68567

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=C(C1=CC=CC=C1)Cl)I)OCC(=O)OC

Isomeric SMILES

CCCCC(/C(=C(/C1=CC=CC=C1)\Cl)/I)OCC(=O)OC

InChI

InChI=1S/C16H20ClIO3/c1-3-4-10-13(21-11-14(19)20-2)16(18)15(17)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3/b16-15+