2-(7-fluoranyl-6-isocyanato-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanenitrile

Systemtic Name: 2-(7-fluoranyl-6-isocyanato-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanenitrile Openeye Name: 2-(7-fluoro-6-isocyanato-3-oxo-1,4-benzoxazin-4-yl)acetonitrile CAS Name: 2-(7-fluoro-6-isocyanato-3-oxo-1,4-benzoxazin-4-yl)acetonitrile IUPAC Name: 2-(7-fluoro-6-isocyanato-3-oxo-1,4-benzoxazin-4-yl)acetonitrile Traditional Name: 2-(7-fluoro-6-isocyanato-3-keto-1,4-benzoxazin-4-yl)acetonitrile Formula: C11H6FN3O3 MolecularWeight: 247.182043

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C(=C2)N=C=O)F)CC#N

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C(=C2)N=C=O)F)CC#N

InChI

InChI=1S/C11H6FN3O3/c12-7-3-10-9(4-8(7)14-6-16)15(2-1-13)11(17)5-18-10/h3-4H,2,5H2