4-[5-fluoranyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]butanoic acid

Systemtic Name: 4-[5-fluoranyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]butanoic acid Openeye Name: 4-[5-fluoro-2-oxo-1-(4-pyridylmethyl)acenaphthylen-1-yl]butanoic acid CAS Name: 4-[5-fluoro-2-oxo-1-(pyridin-4-ylmethyl)-1-acenaphthylenyl]butanoic acid IUPAC Name: 4-[5-fluoro-2-oxo-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]butanoic acid Traditional Name: 4-[5-fluoro-2-keto-1-(4-pyridylmethyl)acenaphthen-1-yl]butyric acid Formula: C22H18FNO3 MolecularWeight: 363.381623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(C3=O)(CCCC(=O)O)CC4=CC=NC=C4)F

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(C3=O)(CCCC(=O)O)CC4=CC=NC=C4)F

InChI

InChI=1S/C22H18FNO3/c23-18-7-6-16-20-15(18)3-1-4-17(20)22(21(16)27,10-2-5-19(25)26)13-14-8-11-24-12-9-14/h1,3-4,6-9,11-12H,2,5,10,13H2,(H,25,26)