3-(4-ethylphenyl)-2-(2-methoxyphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(4-ethylphenyl)-2-(2-methoxyphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(4-ethylphenyl)-2-(2-methoxyphenyl)-3-oxo-propanenitrile CAS Name: 3-(4-ethylphenyl)-2-(2-methoxyphenyl)-3-oxopropanenitrile IUPAC Name: 3-(4-ethylphenyl)-2-(2-methoxyphenyl)-3-oxopropanenitrile Traditional Name: 3-(4-ethylphenyl)-3-keto-2-(2-methoxyphenyl)propionitrile Formula: C18H17NO2 MolecularWeight: 279.33308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C#N)C2=CC=CC=C2OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C#N)C2=CC=CC=C2OC

InChI

InChI=1S/C18H17NO2/c1-3-13-8-10-14(11-9-13)18(20)16(12-19)15-6-4-5-7-17(15)21-2/h4-11,16H,3H2,1-2H3