4-(hydroxymethyl)-5-iodanyl-2-(2-methylphenyl)benzoic acid

Systemtic Name: 4-(hydroxymethyl)-5-iodanyl-2-(2-methylphenyl)benzoic acid Openeye Name: 4-(hydroxymethyl)-5-iodo-2-(o-tolyl)benzoic acid CAS Name: 4-(hydroxymethyl)-5-iodo-2-(2-methylphenyl)benzoic acid IUPAC Name: 4-(hydroxymethyl)-5-iodo-2-(2-methylphenyl)benzoic acid Traditional Name: 5-iodo-4-methylol-2-(o-tolyl)benzoic acid Formula: C15H13IO3 MolecularWeight: 368.16639

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C(C=C2C(=O)O)I)CO

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C(C=C2C(=O)O)I)CO

InChI

InChI=1S/C15H13IO3/c1-9-4-2-3-5-11(9)12-6-10(8-17)14(16)7-13(12)15(18)19/h2-7,17H,8H2,1H3,(H,18,19)