2-methyl-3-oxidanylidene-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanenitrile

Systemtic Name: 2-methyl-3-oxidanylidene-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanenitrile Openeye Name: 2-methyl-3-oxo-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanenitrile CAS Name: 2-methyl-3-oxo-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanenitrile IUPAC Name: 2-methyl-3-oxo-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanenitrile Traditional Name: 3-keto-2-methyl-3-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propionitrile Formula: C13H15NOS MolecularWeight: 233.3293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C(=O)C1=CC2=C(S1)CCCCC2

Isomeric SMILES

CC(C#N)C(=O)C1=CC2=C(S1)CCCCC2

InChI

InChI=1S/C13H15NOS/c1-9(8-14)13(15)12-7-10-5-3-2-4-6-11(10)16-12/h7,9H,2-6H2,1H3