6,6-dimethyl-4-oxidanylidene-3-propyl-5,7-dihydro-2-benzothiophene-1-carbonitrile

Systemtic Name: 6,6-dimethyl-4-oxidanylidene-3-propyl-5,7-dihydro-2-benzothiophene-1-carbonitrile Openeye Name: 6,6-dimethyl-4-oxo-3-propyl-5,7-dihydro-2-benzothiophene-1-carbonitrile CAS Name: 6,6-dimethyl-4-oxo-3-propyl-5,7-dihydro-2-benzothiophene-1-carbonitrile IUPAC Name: 6,6-dimethyl-4-oxo-3-propyl-5,7-dihydro-2-benzothiophene-1-carbonitrile Traditional Name: 4-keto-6,6-dimethyl-3-propyl-5,7-dihydroisobenzothiophene-1-carbonitrile Formula: C14H17NOS MolecularWeight: 247.35588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=C(S1)C#N)CC(CC2=O)(C)C

Isomeric SMILES

CCCC1=C2C(=C(S1)C#N)CC(CC2=O)(C)C

InChI

InChI=1S/C14H17NOS/c1-4-5-11-13-9(12(8-15)17-11)6-14(2,3)7-10(13)16/h4-7H2,1-3H3