3-[(4-oxidanylidene-[1]benzofuro[3,2-d]pyrimidin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(4-oxidanylidene-[1]benzofuro[3,2-d]pyrimidin-3-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(4-oxobenzofuro[3,2-d]pyrimidin-3-yl)methyl]benzonitrile CAS Name: 3-[(4-oxo-3-benzofuro[3,2-d]pyrimidinyl)methyl]benzonitrile IUPAC Name: 3-[(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)methyl]benzonitrile Traditional Name: 3-[(4-ketobenzofuro[3,2-d]pyrimidin-3-yl)methyl]benzonitrile Formula: C18H11N3O2 MolecularWeight: 301.29884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=O)N(C=N3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=O)N(C=N3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C18H11N3O2/c19-9-12-4-3-5-13(8-12)10-21-11-20-16-14-6-1-2-7-15(14)23-17(16)18(21)22/h1-8,11H,10H2