2-(2,3-dimethoxyphenyl)carbonylbutanenitrile

Systemtic Name: 2-(2,3-dimethoxyphenyl)carbonylbutanenitrile Openeye Name: 2-(2,3-dimethoxybenzoyl)butanenitrile CAS Name: 2-[(2,3-dimethoxyphenyl)-oxomethyl]butanenitrile IUPAC Name: 2-(2,3-dimethoxybenzoyl)butanenitrile Traditional Name: 2-o-veratroylbutyronitrile Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C(=O)C1=C(C(=CC=C1)OC)OC

Isomeric SMILES

CCC(C#N)C(=O)C1=C(C(=CC=C1)OC)OC

InChI

InChI=1S/C13H15NO3/c1-4-9(8-14)12(15)10-6-5-7-11(16-2)13(10)17-3/h5-7,9H,4H2,1-3H3