2-[2,7-bis(oxidanylidene)azepan-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[2,7-bis(oxidanylidene)azepan-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-(2,7-dioxoazepan-1-yl)-6-fluoro-benzonitrile CAS Name: 2-(2,7-dioxo-1-azepanyl)-6-fluorobenzonitrile IUPAC Name: 2-(2,7-dioxoazepan-1-yl)-6-fluorobenzonitrile Traditional Name: 2-(2,7-diketoazepan-1-yl)-6-fluoro-benzonitrile Formula: C13H11FN2O2 MolecularWeight: 246.237043

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)C2=C(C(=CC=C2)F)C#N

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)C2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C13H11FN2O2/c14-10-4-3-5-11(9(10)8-15)16-12(17)6-1-2-7-13(16)18/h3-5H,1-2,6-7H2