3-[[3-(cyanomethyl)-2,6-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-(cyanomethyl)-2,6-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[3-(cyanomethyl)-2,6-dioxo-pyrimidin-1-yl]methyl]benzonitrile CAS Name: 3-[[3-(cyanomethyl)-2,6-dioxo-1-pyrimidinyl]methyl]benzonitrile IUPAC Name: 3-[[3-(cyanomethyl)-2,6-dioxopyrimidin-1-yl]methyl]benzonitrile Traditional Name: 3-[[3-(cyanomethyl)-2,6-diketo-pyrimidin-1-yl]methyl]benzonitrile Formula: C14H10N4O2 MolecularWeight: 266.2548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C(=O)C=CN(C2=O)CC#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C(=O)C=CN(C2=O)CC#N)C#N

InChI

InChI=1S/C14H10N4O2/c15-5-7-17-6-4-13(19)18(14(17)20)10-12-3-1-2-11(8-12)9-16/h1-4,6,8H,7,10H2