O2-ethyl O1-(4-methylpentyl) 4-iodanylbenzene-1,2-dicarboxylate

Systemtic Name: O2-ethyl O1-(4-methylpentyl) 4-iodanylbenzene-1,2-dicarboxylate Openeye Name: O2-ethyl O1-isohexyl 4-iodobenzene-1,2-dicarboxylate CAS Name: 4-iodobenzene-1,2-dicarboxylic acid O2-ethyl ester O1-(4-methylpentyl) ester IUPAC Name: 2-O-ethyl 1-O-(4-methylpentyl) 4-iodobenzene-1,2-dicarboxylate Traditional Name: 4-iodobenzene-1,2-dicarboxylic acid O2-ethyl ester O1-isohexyl ester Formula: C16H21IO4 MolecularWeight: 404.24001

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)I)C(=O)OCCCC(C)C

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)I)C(=O)OCCCC(C)C

InChI

InChI=1S/C16H21IO4/c1-4-20-16(19)14-10-12(17)7-8-13(14)15(18)21-9-5-6-11(2)3/h7-8,10-11H,4-6,9H2,1-3H3