3-iodanyl-4-(propan-2-yloxymethyl)benzoic acid

Systemtic Name: 3-iodanyl-4-(propan-2-yloxymethyl)benzoic acid Openeye Name: 3-iodo-4-(isopropoxymethyl)benzoic acid CAS Name: 3-iodo-4-(propan-2-yloxymethyl)benzoic acid IUPAC Name: 3-iodo-4-(propan-2-yloxymethyl)benzoic acid Traditional Name: 3-iodo-4-(isopropoxymethyl)benzoic acid Formula: C11H13IO3 MolecularWeight: 320.12359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=C(C=C(C=C1)C(=O)O)I

Isomeric SMILES

CC(C)OCC1=C(C=C(C=C1)C(=O)O)I

InChI

InChI=1S/C11H13IO3/c1-7(2)15-6-9-4-3-8(11(13)14)5-10(9)12/h3-5,7H,6H2,1-2H3,(H,13,14)