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

Systemtic Name: 2-(9-azanyl-2-cyclobutyl-1-oxidanylidene-3H-pyrrolo[3,4-b]quinolin-5-yl)benzenecarbonitrile Openeye Name: 2-(9-amino-2-cyclobutyl-1-oxo-3H-pyrrolo[3,4-b]quinolin-5-yl)benzonitrile CAS Name: 2-(9-amino-2-cyclobutyl-1-oxo-3H-pyrrolo[3,4-b]quinolin-5-yl)benzonitrile IUPAC Name: 2-(9-amino-2-cyclobutyl-1-oxo-3H-pyrrolo[3,4-b]quinolin-5-yl)benzonitrile Traditional Name: 2-(9-amino-2-cyclobutyl-1-keto-3H-pyrrolo[3,4-b]quinolin-5-yl)benzonitrile Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CC3=NC4=C(C=CC=C4C5=CC=CC=C5C#N)C(=C3C2=O)N

Isomeric SMILES

C1CC(C1)N2CC3=NC4=C(C=CC=C4C5=CC=CC=C5C#N)C(=C3C2=O)N

InChI

InChI=1S/C22H18N4O/c23-11-13-5-1-2-8-15(13)16-9-4-10-17-20(24)19-18(25-21(16)17)12-26(22(19)27)14-6-3-7-14/h1-2,4-5,8-10,14H,3,6-7,12H2,(H2,24,25)