6-chloranyl-2-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]quinoline-4-carboxylate

Systemtic Name: 6-chloranyl-2-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]quinoline-4-carboxylate Openeye Name: 6-chloro-2-[5-(3-chloro-4-methyl-phenyl)-2-furyl]quinoline-4-carboxylate CAS Name: 6-chloro-2-[5-(3-chloro-4-methylphenyl)-2-furanyl]-4-quinolinecarboxylate IUPAC Name: 6-chloro-2-[5-(3-chloro-4-methylphenyl)furan-2-yl]quinoline-4-carboxylate Traditional Name: 6-chloro-2-[5-(3-chloro-4-methyl-phenyl)-2-furyl]cinchoninate Formula: C21H12Cl2NO3- MolecularWeight: 397.23088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C(=O)[O-])Cl

InChI

InChI=1S/C21H13Cl2NO3/c1-11-2-3-12(8-16(11)23)19-6-7-20(27-19)18-10-15(21(25)26)14-9-13(22)4-5-17(14)24-18/h2-10H,1H3,(H,25,26)/p-1