2-(2,4-dimethylphenyl)-6-fluoranyl-quinoline-4-carboxylate

Systemtic Name: 2-(2,4-dimethylphenyl)-6-fluoranyl-quinoline-4-carboxylate Openeye Name: 2-(2,4-dimethylphenyl)-6-fluoro-quinoline-4-carboxylate CAS Name: 2-(2,4-dimethylphenyl)-6-fluoro-4-quinolinecarboxylate IUPAC Name: 2-(2,4-dimethylphenyl)-6-fluoroquinoline-4-carboxylate Traditional Name: 2-(2,4-dimethylphenyl)-6-fluoro-cinchoninate Formula: C18H13FNO2- MolecularWeight: 294.299723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)[O-])C

InChI

InChI=1S/C18H14FNO2/c1-10-3-5-13(11(2)7-10)17-9-15(18(21)22)14-8-12(19)4-6-16(14)20-17/h3-9H,1-2H3,(H,21,22)/p-1