2-oxidanyl-2-(2,4,5-trimethoxyphenyl)ethanenitrile

Systemtic Name: 2-oxidanyl-2-(2,4,5-trimethoxyphenyl)ethanenitrile Openeye Name: 2-hydroxy-2-(2,4,5-trimethoxyphenyl)acetonitrile CAS Name: 2-hydroxy-2-(2,4,5-trimethoxyphenyl)acetonitrile IUPAC Name: 2-hydroxy-2-(2,4,5-trimethoxyphenyl)acetonitrile Traditional Name: 2-asaryl-2-hydroxy-acetonitrile Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(C#N)O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(C#N)O)OC)OC

InChI

InChI=1S/C11H13NO4/c1-14-9-5-11(16-3)10(15-2)4-7(9)8(13)6-12/h4-5,8,13H,1-3H3