3-(2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-yl)benzenecarbonitrile

Systemtic Name: 3-(2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-yl)benzenecarbonitrile Openeye Name: 3-(2,2-dimethyl-6-oxo-1,3-dioxin-4-yl)benzonitrile CAS Name: 3-(2,2-dimethyl-6-oxo-1,3-dioxin-4-yl)benzonitrile IUPAC Name: 3-(2,2-dimethyl-6-oxo-1,3-dioxin-4-yl)benzonitrile Traditional Name: 3-(6-keto-2,2-dimethyl-1,3-dioxin-4-yl)benzonitrile Formula: C13H11NO3 MolecularWeight: 229.23134

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=CC(=O)O1)C2=CC=CC(=C2)C#N)C

Isomeric SMILES

CC1(OC(=CC(=O)O1)C2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C13H11NO3/c1-13(2)16-11(7-12(15)17-13)10-5-3-4-9(6-10)8-14/h3-7H,1-2H3