sodium 2-[4-(4-chlorophenyl)phenyl]-6-fluoranyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: sodium 2-[4-(4-chlorophenyl)phenyl]-6-fluoranyl-3-methyl-quinoline-4-carboxylate Openeye Name: sodium 2-[4-(4-chlorophenyl)phenyl]-6-fluoro-3-methyl-quinoline-4-carboxylate CAS Name: sodium 2-[4-(4-chlorophenyl)phenyl]-6-fluoro-3-methyl-4-quinolinecarboxylate IUPAC Name: sodium 2-[4-(4-chlorophenyl)phenyl]-6-fluoro-3-methylquinoline-4-carboxylate Traditional Name: sodium 2-[4-(4-chlorophenyl)phenyl]-6-fluoro-3-methyl-cinchoninate Formula: C23H14ClFNNaO2 MolecularWeight: 413.803933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl.[Na+]

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl.[Na+]

InChI

InChI=1S/C23H15ClFNO2.Na/c1-13-21(23(27)28)19-12-18(25)10-11-20(19)26-22(13)16-4-2-14(3-5-16)15-6-8-17(24)9-7-15;/h2-12H,1H3,(H,27,28);/q;+1/p-1