2-(3,4-diethoxyphenyl)carbonylbutanenitrile

Systemtic Name: 2-(3,4-diethoxyphenyl)carbonylbutanenitrile Openeye Name: 2-(3,4-diethoxybenzoyl)butanenitrile CAS Name: 2-[(3,4-diethoxyphenyl)-oxomethyl]butanenitrile IUPAC Name: 2-(3,4-diethoxybenzoyl)butanenitrile Traditional Name: 2-(3,4-diethoxybenzoyl)butyronitrile Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-4-11(10-16)15(17)12-7-8-13(18-5-2)14(9-12)19-6-3/h7-9,11H,4-6H2,1-3H3