(7aS)-2-oxidanylidene-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carbonitrile

Systemtic Name: (7aS)-2-oxidanylidene-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carbonitrile Openeye Name: (7aS)-2-oxo-5,6,7,7a-tetrahydro-4H-benzothiophene-3-carbonitrile CAS Name: (7aS)-2-oxo-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carbonitrile IUPAC Name: (7aS)-2-oxo-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carbonitrile Traditional Name: (7aS)-2-keto-5,6,7,7a-tetrahydro-4H-benzothiophene-3-carbonitrile Formula: C9H9NOS MolecularWeight: 179.23886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C(=O)SC2C1)C#N

Isomeric SMILES

C1CCC2=C(C(=O)S[C@H]2C1)C#N

InChI

InChI=1S/C9H9NOS/c10-5-7-6-3-1-2-4-8(6)12-9(7)11/h8H,1-4H2/t8-/m0/s1