[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl 2-iodanylbenzoate

Systemtic Name: [5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl 2-iodanylbenzoate Openeye Name: [3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl 2-iodobenzoate CAS Name: 2-iodobenzoic acid [3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl ester IUPAC Name: [3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl 2-iodobenzoate Traditional Name: 2-iodobenzoic acid (3-hydroxy-2-methyl-5-methylol-4-pyridyl)methyl ester Formula: C15H14INO4 MolecularWeight: 399.18043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)COC(=O)C2=CC=CC=C2I)CO

Isomeric SMILES

CC1=NC=C(C(=C1O)COC(=O)C2=CC=CC=C2I)CO

InChI

InChI=1S/C15H14INO4/c1-9-14(19)12(10(7-18)6-17-9)8-21-15(20)11-4-2-3-5-13(11)16/h2-6,18-19H,7-8H2,1H3