4-[8-(3-chloranyl-4-fluoranyl-phenyl)-1,7-naphthyridin-6-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[8-(3-chloranyl-4-fluoranyl-phenyl)-1,7-naphthyridin-6-yl]cyclohexane-1-carboxylic acid Openeye Name: 4-[8-(3-chloro-4-fluoro-phenyl)-1,7-naphthyridin-6-yl]cyclohexanecarboxylic acid CAS Name: 4-[8-(3-chloro-4-fluorophenyl)-1,7-naphthyridin-6-yl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[8-(3-chloro-4-fluorophenyl)-1,7-naphthyridin-6-yl]cyclohexane-1-carboxylic acid Traditional Name: 4-[8-(3-chloro-4-fluoro-phenyl)-1,7-naphthyridin-6-yl]cyclohexanecarboxylic acid Formula: C21H18ClFN2O2 MolecularWeight: 384.831223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=NC(=C3C(=C2)C=CC=N3)C4=CC(=C(C=C4)F)Cl)C(=O)O

Isomeric SMILES

C1CC(CCC1C2=NC(=C3C(=C2)C=CC=N3)C4=CC(=C(C=C4)F)Cl)C(=O)O

InChI

InChI=1S/C21H18ClFN2O2/c22-16-10-15(7-8-17(16)23)20-19-14(2-1-9-24-19)11-18(25-20)12-3-5-13(6-4-12)21(26)27/h1-2,7-13H,3-6H2,(H,26,27)