2-(5-ethyl-8-fluoranyl-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indol-1-yl)ethanenitrile

Systemtic Name: 2-(5-ethyl-8-fluoranyl-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indol-1-yl)ethanenitrile Openeye Name: 2-(5-ethyl-8-fluoro-4-oxo-3-phenyl-pyridazino[4,5-b]indol-1-yl)acetonitrile CAS Name: 2-(5-ethyl-8-fluoro-4-oxo-3-phenyl-1-pyridazino[4,5-b]indolyl)acetonitrile IUPAC Name: 2-(5-ethyl-8-fluoro-4-oxo-3-phenylpyridazino[4,5-b]indol-1-yl)acetonitrile Traditional Name: 2-(5-ethyl-8-fluoro-4-keto-3-phenyl-pyridazin[4,5-b]indol-1-yl)acetonitrile Formula: C20H15FN4O MolecularWeight: 346.357703

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)F)C3=C1C(=O)N(N=C3CC#N)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)F)C3=C1C(=O)N(N=C3CC#N)C4=CC=CC=C4

InChI

InChI=1S/C20H15FN4O/c1-2-24-17-9-8-13(21)12-15(17)18-16(10-11-22)23-25(20(26)19(18)24)14-6-4-3-5-7-14/h3-9,12H,2,10H2,1H3