ethyl 6-iodanyl-2-methyl-2-[2-[(Z)-3-phenylprop-2-enoxy]propan-2-yl]hexanoate

Systemtic Name: ethyl 6-iodanyl-2-methyl-2-[2-[(Z)-3-phenylprop-2-enoxy]propan-2-yl]hexanoate Openeye Name: ethyl 2-[1-[(Z)-cinnamyl]oxy-1-methyl-ethyl]-6-iodo-2-methyl-hexanoate CAS Name: 6-iodo-2-methyl-2-[2-[(Z)-3-phenylprop-2-enoxy]propan-2-yl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-iodo-2-methyl-2-[2-[(Z)-3-phenylprop-2-enoxy]propan-2-yl]hexanoate Traditional Name: 2-[1-[(Z)-cinnamyl]oxy-1-methyl-ethyl]-6-iodo-2-methyl-hexanoic acid ethyl ester Formula: C21H31IO3 MolecularWeight: 458.37351

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CCCCI)C(C)(C)OCC=CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(C)(CCCCI)C(C)(C)OC/C=C\C1=CC=CC=C1

InChI

InChI=1S/C21H31IO3/c1-5-24-19(23)21(4,15-9-10-16-22)20(2,3)25-17-11-14-18-12-7-6-8-13-18/h6-8,11-14H,5,9-10,15-17H2,1-4H3/b14-11-