3-(3,4-diethoxyphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(3,4-diethoxyphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(3,4-diethoxyphenyl)-3-oxo-propanenitrile CAS Name: 3-(3,4-diethoxyphenyl)-3-oxopropanenitrile IUPAC Name: 3-(3,4-diethoxyphenyl)-3-oxopropanenitrile Traditional Name: 3-(3,4-diethoxyphenyl)-3-keto-propionitrile Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)CC#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)CC#N)OCC

InChI

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