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

Systemtic Name: 2-[7-(3-fluoranyl-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]ethanenitrile Openeye Name: 2-[7-(3-fluoro-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]acetonitrile CAS Name: 2-[7-(3-fluoro-4-methoxyphenyl)-1-pyrazolo[4,3-g]quinoxalinyl]acetonitrile IUPAC Name: 2-[7-(3-fluoro-4-methoxyphenyl)pyrazolo[4,3-g]quinoxalin-1-yl]acetonitrile Traditional Name: 2-[7-(3-fluoro-4-methoxy-phenyl)pyrazolo[4,3-g]quinoxalin-1-yl]acetonitrile Formula: C18H12FN5O MolecularWeight: 333.319183

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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#N)F

Isomeric SMILES

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

InChI

InChI=1S/C18H12FN5O/c1-25-18-3-2-11(6-13(18)19)16-10-21-14-7-12-9-22-24(5-4-20)17(12)8-15(14)23-16/h2-3,6-10H,5H2,1H3