2-(4-iodophenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-iodophenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: 2-(4-iodophenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-iodophenyl)-8-methyl-4-quinolinecarboxylate IUPAC Name: 2-(4-iodophenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-iodophenyl)-8-methyl-cinchoninate Formula: C17H11INO2- MolecularWeight: 388.17921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)[O-])C3=CC=C(C=C3)I

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)[O-])C3=CC=C(C=C3)I

InChI

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