2-(4-iodophenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-iodophenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: 2-(4-iodophenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-iodophenyl)-6-methyl-4-quinolinecarboxylate IUPAC Name: 2-(4-iodophenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-iodophenyl)-6-methyl-cinchoninate Formula: C17H11INO2- MolecularWeight: 388.17921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC=C(C=C3)I

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC=C(C=C3)I

InChI

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