2-[7-(3-fluoranyl-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]ethanoic acid

Systemtic Name: 2-[7-(3-fluoranyl-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]ethanoic acid Openeye Name: 2-[7-(3-fluoro-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]acetic acid CAS Name: 2-[7-(3-fluoro-4-methoxyphenyl)-1-pyrazolo[4,3-g]quinoxalinyl]acetic acid IUPAC Name: 2-[7-(3-fluoro-4-methoxyphenyl)pyrazolo[4,3-g]quinoxalin-1-yl]acetic acid Traditional Name: 2-[7-(3-fluoro-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]acetic acid Formula: C18H13FN4O3 MolecularWeight: 352.319223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=C3C=C4C=NN(C4=CC3=N2)CC(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=C3C=C4C=NN(C4=CC3=N2)CC(=O)O)F

InChI

InChI=1S/C18H13FN4O3/c1-26-17-3-2-10(4-12(17)19)15-8-20-13-5-11-7-21-23(9-18(24)25)16(11)6-14(13)22-15/h2-8H,9H2,1H3,(H,24,25)