methyl 2-(4-iodophenyl)quinoline-4-carboxylate

Systemtic Name: methyl 2-(4-iodophenyl)quinoline-4-carboxylate Openeye Name: methyl 2-(4-iodophenyl)quinoline-4-carboxylate CAS Name: 2-(4-iodophenyl)-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-iodophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-iodophenyl)cinchoninic acid methyl ester Formula: C17H12INO2 MolecularWeight: 389.18715

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)I

Isomeric SMILES

COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)I

InChI

InChI=1S/C17H12INO2/c1-21-17(20)14-10-16(11-6-8-12(18)9-7-11)19-15-5-3-2-4-13(14)15/h2-10H,1H3