4-iodanyl-3-(3-methoxyphenyl)-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-iodanyl-3-(3-methoxyphenyl)-1,2-thiazole-5-carboxylic acid Openeye Name: 4-iodo-3-(3-methoxyphenyl)isothiazole-5-carboxylic acid CAS Name: 4-iodo-3-(3-methoxyphenyl)-5-isothiazolecarboxylic acid IUPAC Name: 4-iodo-3-(3-methoxyphenyl)-1,2-thiazole-5-carboxylic acid Traditional Name: 4-iodo-3-(3-methoxyphenyl)isothiazole-5-carboxylic acid Formula: C11H8INO3S MolecularWeight: 361.15559

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NSC(=C2I)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=NSC(=C2I)C(=O)O

InChI

InChI=1S/C11H8INO3S/c1-16-7-4-2-3-6(5-7)9-8(12)10(11(14)15)17-13-9/h2-5H,1H3,(H,14,15)