methyl (10bR)-9-iodanyl-2,4-dimethyl-5-oxidanylidene-4a,10b-dihydrochromeno[3,4-c]pyridine-1-carboxylate

Systemtic Name: methyl (10bR)-9-iodanyl-2,4-dimethyl-5-oxidanylidene-4a,10b-dihydrochromeno[3,4-c]pyridine-1-carboxylate Openeye Name: methyl (10bR)-9-iodo-2,4-dimethyl-5-oxo-4a,10b-dihydrochromeno[3,4-c]pyridine-1-carboxylate CAS Name: (10bR)-9-iodo-2,4-dimethyl-5-oxo-4a,10b-dihydro[1]benzopyrano[3,4-c]pyridine-1-carboxylic acid methyl ester IUPAC Name: methyl (10bR)-9-iodo-2,4-dimethyl-5-oxo-4a,10b-dihydrochromeno[3,4-c]pyridine-1-carboxylate Traditional Name: (10bR)-9-iodo-5-keto-2,4-dimethyl-4a,10b-dihydrochromeno[3,4-c]pyridine-1-carboxylic acid methyl ester Formula: C16H14INO4 MolecularWeight: 411.19113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C2C1C(=O)OC3=C2C=C(C=C3)I)C(=O)OC)C

Isomeric SMILES

CC1=NC(=C([C@@H]2C1C(=O)OC3=C2C=C(C=C3)I)C(=O)OC)C

InChI

InChI=1S/C16H14INO4/c1-7-12(15(19)21-3)14-10-6-9(17)4-5-11(10)22-16(20)13(14)8(2)18-7/h4-6,13-14H,1-3H3/t13?,14-/m1/s1