2-oxidanylidene-2-(2,3,4-trimethoxy-6-methyl-phenyl)ethanenitrile

Systemtic Name: 2-oxidanylidene-2-(2,3,4-trimethoxy-6-methyl-phenyl)ethanenitrile Openeye Name: 2,3,4-trimethoxy-6-methyl-benzoyl cyanide CAS Name: 2-oxo-2-(2,3,4-trimethoxy-6-methylphenyl)acetonitrile IUPAC Name: 2,3,4-trimethoxy-6-methylbenzoyl cyanide Traditional Name: 2-keto-2-(2,3,4-trimethoxy-6-methyl-phenyl)acetonitrile Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C#N)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C#N)OC)OC)OC

InChI

InChI=1S/C12H13NO4/c1-7-5-9(15-2)11(16-3)12(17-4)10(7)8(14)6-13/h5H,1-4H3