methyl 2-(4-iodanylbutyl)-1-[(4-methoxyphenyl)methyl]-4-oxidanylidene-3H-pyridine-2-carboxylate

Systemtic Name: methyl 2-(4-iodanylbutyl)-1-[(4-methoxyphenyl)methyl]-4-oxidanylidene-3H-pyridine-2-carboxylate Openeye Name: methyl 2-(4-iodobutyl)-1-[(4-methoxyphenyl)methyl]-4-oxo-3H-pyridine-2-carboxylate CAS Name: 2-(4-iodobutyl)-1-[(4-methoxyphenyl)methyl]-4-oxo-3H-pyridine-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-iodobutyl)-1-[(4-methoxyphenyl)methyl]-4-oxo-3H-pyridine-2-carboxylate Traditional Name: 2-(4-iodobutyl)-4-keto-1-p-anisyl-3H-pyridine-2-carboxylic acid methyl ester Formula: C19H24INO4 MolecularWeight: 457.30263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=CC(=O)CC2(CCCCI)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=CC(=O)CC2(CCCCI)C(=O)OC

InChI

InChI=1S/C19H24INO4/c1-24-17-7-5-15(6-8-17)14-21-12-9-16(22)13-19(21,18(23)25-2)10-3-4-11-20/h5-9,12H,3-4,10-11,13-14H2,1-2H3