3-oxidanylidene-2-phenyl-6-thiophen-2-yl-hexanenitrile

Systemtic Name: 3-oxidanylidene-2-phenyl-6-thiophen-2-yl-hexanenitrile Openeye Name: 3-oxo-2-phenyl-6-(2-thienyl)hexanenitrile CAS Name: 3-oxo-2-phenyl-6-thiophen-2-ylhexanenitrile IUPAC Name: 3-oxo-2-phenyl-6-thiophen-2-ylhexanenitrile Traditional Name: 3-keto-2-phenyl-6-(2-thienyl)hexanenitrile Formula: C16H15NOS MolecularWeight: 269.3614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C(=O)CCCC2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)C(=O)CCCC2=CC=CS2

InChI

InChI=1S/C16H15NOS/c17-12-15(13-6-2-1-3-7-13)16(18)10-4-8-14-9-5-11-19-14/h1-3,5-7,9,11,15H,4,8,10H2