ethyl 1-tert-butyl-6-iodanyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-tert-butyl-6-iodanyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-tert-butyl-6-iodo-4-oxo-quinoline-3-carboxylate CAS Name: 1-tert-butyl-6-iodo-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-tert-butyl-6-iodo-4-oxoquinoline-3-carboxylate Traditional Name: 1-tert-butyl-6-iodo-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C16H18INO3 MolecularWeight: 399.22349

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)I)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)I)C(C)(C)C

InChI

InChI=1S/C16H18INO3/c1-5-21-15(20)12-9-18(16(2,3)4)13-7-6-10(17)8-11(13)14(12)19/h6-9H,5H2,1-4H3