dimethyl 6-butyl-3,5-bis(iodanyl)-2-oxidanylidene-1,3-dihydropyridine-4,4-dicarboxylate

Systemtic Name: dimethyl 6-butyl-3,5-bis(iodanyl)-2-oxidanylidene-1,3-dihydropyridine-4,4-dicarboxylate Openeye Name: dimethyl 6-butyl-3,5-diiodo-2-oxo-1,3-dihydropyridine-4,4-dicarboxylate CAS Name: 6-butyl-3,5-diiodo-2-oxo-1,3-dihydropyridine-4,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6-butyl-3,5-diiodo-2-oxo-1,3-dihydropyridine-4,4-dicarboxylate Traditional Name: 6-butyl-3,5-diiodo-2-keto-1,3-dihydropyridine-4,4-dicarboxylic acid dimethyl ester Formula: C13H17I2NO5 MolecularWeight: 521.08672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(C(C(=O)N1)I)(C(=O)OC)C(=O)OC)I

Isomeric SMILES

CCCCC1=C(C(C(C(=O)N1)I)(C(=O)OC)C(=O)OC)I

InChI

InChI=1S/C13H17I2NO5/c1-4-5-6-7-8(14)13(11(18)20-2,12(19)21-3)9(15)10(17)16-7/h9H,4-6H2,1-3H3,(H,16,17)