2-(6-ethanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanenitrile

Systemtic Name: 2-(6-ethanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanenitrile Openeye Name: 2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetonitrile CAS Name: 2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetonitrile IUPAC Name: 2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetonitrile Traditional Name: 2-(6-acetyl-3-keto-2,2-dimethyl-1,4-benzoxazin-4-yl)acetonitrile Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC#N)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC#N)(C)C

InChI

InChI=1S/C14H14N2O3/c1-9(17)10-4-5-12-11(8-10)16(7-6-15)13(18)14(2,3)19-12/h4-5,8H,7H2,1-3H3