2-(9-azanyl-2-cyclobutyl-1-oxidanylidene-3H-pyrrolo[3,4-b]quinolin-5-yl)-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-(9-azanyl-2-cyclobutyl-1-oxidanylidene-3H-pyrrolo[3,4-b]quinolin-5-yl)-4-fluoranyl-benzenecarbonitrile Openeye Name: 2-(9-amino-2-cyclobutyl-1-oxo-3H-pyrrolo[3,4-b]quinolin-5-yl)-4-fluoro-benzonitrile CAS Name: 2-(9-amino-2-cyclobutyl-1-oxo-3H-pyrrolo[3,4-b]quinolin-5-yl)-4-fluorobenzonitrile IUPAC Name: 2-(9-amino-2-cyclobutyl-1-oxo-3H-pyrrolo[3,4-b]quinolin-5-yl)-4-fluorobenzonitrile Traditional Name: 2-(9-amino-2-cyclobutyl-1-keto-3H-pyrrolo[3,4-b]quinolin-5-yl)-4-fluoro-benzonitrile Formula: C22H17FN4O MolecularWeight: 372.394983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CC3=NC4=C(C=CC=C4C5=C(C=CC(=C5)F)C#N)C(=C3C2=O)N

Isomeric SMILES

C1CC(C1)N2CC3=NC4=C(C=CC=C4C5=C(C=CC(=C5)F)C#N)C(=C3C2=O)N

InChI

InChI=1S/C22H17FN4O/c23-13-8-7-12(10-24)17(9-13)15-5-2-6-16-20(25)19-18(26-21(15)16)11-27(22(19)28)14-3-1-4-14/h2,5-9,14H,1,3-4,11H2,(H2,25,26)