methyl 6-iodanyl-7-methyl-2-(3-methylimidazol-4-yl)quinoline-4-carboxylate

Systemtic Name: methyl 6-iodanyl-7-methyl-2-(3-methylimidazol-4-yl)quinoline-4-carboxylate Openeye Name: methyl 6-iodo-7-methyl-2-(3-methylimidazol-4-yl)quinoline-4-carboxylate CAS Name: 6-iodo-7-methyl-2-(3-methyl-4-imidazolyl)-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-iodo-7-methyl-2-(3-methylimidazol-4-yl)quinoline-4-carboxylate Traditional Name: 6-iodo-7-methyl-2-(3-methylimidazol-4-yl)cinchoninic acid methyl ester Formula: C16H14IN3O2 MolecularWeight: 407.20573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=NC2=C1)C3=CN=CN3C)C(=O)OC)I

Isomeric SMILES

CC1=C(C=C2C(=CC(=NC2=C1)C3=CN=CN3C)C(=O)OC)I

InChI

InChI=1S/C16H14IN3O2/c1-9-4-13-10(5-12(9)17)11(16(21)22-3)6-14(19-13)15-7-18-8-20(15)2/h4-8H,1-3H3