diethyl 2-[(2Z)-3-iodanyl-5-methyl-hexa-2,5-dienyl]-2-(5-methylhex-5-en-2-ynyl)propanedioate

Systemtic Name: diethyl 2-[(2Z)-3-iodanyl-5-methyl-hexa-2,5-dienyl]-2-(5-methylhex-5-en-2-ynyl)propanedioate Openeye Name: diethyl 2-[(2Z)-3-iodo-5-methyl-hexa-2,5-dienyl]-2-(5-methylhex-5-en-2-ynyl)propanedioate CAS Name: 2-[(2Z)-3-iodo-5-methylhexa-2,5-dienyl]-2-(5-methylhex-5-en-2-ynyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2Z)-3-iodo-5-methylhexa-2,5-dienyl]-2-(5-methylhex-5-en-2-ynyl)propanedioate Traditional Name: 2-[(2Z)-3-iodo-5-methyl-hexa-2,5-dienyl]-2-(5-methylhex-5-en-2-ynyl)malonic acid diethyl ester Formula: C21H29IO4 MolecularWeight: 472.35703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C(CC(=C)C)I)(CC#CCC(=C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C/C=C(/CC(=C)C)\I)(CC#CCC(=C)C)C(=O)OCC

InChI

InChI=1S/C21H29IO4/c1-7-25-19(23)21(20(24)26-8-2,13-10-9-11-16(3)4)14-12-18(22)15-17(5)6/h12H,3,5,7-8,11,13-15H2,1-2,4,6H3/b18-12-