3-[[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]methyl]benzenecarbonitrile Openeye Name: 3-[(1,3-dioxo-4H-isoquinolin-2-yl)methyl]benzonitrile CAS Name: 3-[(1,3-dioxo-4H-isoquinolin-2-yl)methyl]benzonitrile IUPAC Name: 3-[(1,3-dioxo-4H-isoquinolin-2-yl)methyl]benzonitrile Traditional Name: 3-[(1,3-diketo-4H-isoquinolin-2-yl)methyl]benzonitrile Formula: C17H12N2O2 MolecularWeight: 276.28938

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H12N2O2/c18-10-12-4-3-5-13(8-12)11-19-16(20)9-14-6-1-2-7-15(14)17(19)21/h1-8H,9,11H2