5-cyclohexyl-4-iodosyl-benzene-1,3-dicarboxylic acid

Systemtic Name: 5-cyclohexyl-4-iodosyl-benzene-1,3-dicarboxylic acid Openeye Name: 5-cyclohexyl-4-iodosyl-benzene-1,3-dicarboxylic acid CAS Name: 5-cyclohexyl-4-iodosylbenzene-1,3-dicarboxylic acid IUPAC Name: 5-cyclohexyl-4-iodosylbenzene-1,3-dicarboxylic acid Traditional Name: 5-cyclohexyl-4-iodosyl-isophthalic acid Formula: C14H15IO5 MolecularWeight: 390.17037

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC(=CC(=C2I=O)C(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC(=CC(=C2I=O)C(=O)O)C(=O)O

InChI

InChI=1S/C14H15IO5/c16-13(17)9-6-10(8-4-2-1-3-5-8)12(15-20)11(7-9)14(18)19/h6-8H,1-5H2,(H,16,17)(H,18,19)