4-[(3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzonitrile CAS Name: 4-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzonitrile IUPAC Name: 4-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzonitrile Traditional Name: 4-[(3-keto-1,4-benzoxazin-4-yl)methyl]benzonitrile Formula: C16H12N2O2 MolecularWeight: 264.27868

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N2O2/c17-9-12-5-7-13(8-6-12)10-18-14-3-1-2-4-15(14)20-11-16(18)19/h1-8H,10-11H2