3-(8-fluoranyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)propanoic acid

Systemtic Name: 3-(8-fluoranyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)propanoic acid Openeye Name: 3-(8-fluoro-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propanoic acid CAS Name: 3-(8-fluoro-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propanoic acid IUPAC Name: 3-(8-fluoro-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propanoic acid Traditional Name: 3-(8-fluoro-4-keto-5H-pyrimid[5,4-b]indol-3-yl)propionic acid Formula: C13H10FN3O3 MolecularWeight: 275.235203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)C3=C(N2)C(=O)N(C=N3)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1F)C3=C(N2)C(=O)N(C=N3)CCC(=O)O

InChI

InChI=1S/C13H10FN3O3/c14-7-1-2-9-8(5-7)11-12(16-9)13(20)17(6-15-11)4-3-10(18)19/h1-2,5-6,16H,3-4H2,(H,18,19)