(2-methylquinolin-8-yl) 4-(5-fluoranyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate

Systemtic Name: (2-methylquinolin-8-yl) 4-(5-fluoranyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate Openeye Name: (2-methyl-8-quinolyl) 4-[5-fluoro-2-(2-pyridyl)-1H-indol-3-yl]butanoate CAS Name: 4-[5-fluoro-2-(2-pyridinyl)-1H-indol-3-yl]butanoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 4-(5-fluoro-2-pyridin-2-yl-1H-indol-3-yl)butanoate Traditional Name: 4-[5-fluoro-2-(2-pyridyl)-1H-indol-3-yl]butyric acid (2-methyl-8-quinolyl) ester Formula: C27H22FN3O2 MolecularWeight: 439.480883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC(=O)CCCC3=C(NC4=C3C=C(C=C4)F)C5=CC=CC=N5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC(=O)CCCC3=C(NC4=C3C=C(C=C4)F)C5=CC=CC=N5)C=C1

InChI

InChI=1S/C27H22FN3O2/c1-17-11-12-18-6-4-9-24(26(18)30-17)33-25(32)10-5-7-20-21-16-19(28)13-14-22(21)31-27(20)23-8-2-3-15-29-23/h2-4,6,8-9,11-16,31H,5,7,10H2,1H3