2-(4,4-dimethylhexan-3-yl)-1-benzothiophene

Systemtic Name: 2-(4,4-dimethylhexan-3-yl)-1-benzothiophene Openeye Name: 2-(1-ethyl-2,2-dimethyl-butyl)benzothiophene CAS Name: 2-(4,4-dimethylhexan-3-yl)-1-benzothiophene IUPAC Name: 2-(4,4-dimethylhexan-3-yl)-1-benzothiophene Traditional Name: 2-(1-ethyl-2,2-dimethyl-butyl)benzothiophene Formula: C16H22S MolecularWeight: 246.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=CC=CC=C2S1)C(C)(C)CC

Isomeric SMILES

CCC(C1=CC2=CC=CC=C2S1)C(C)(C)CC

InChI

InChI=1S/C16H22S/c1-5-13(16(3,4)6-2)15-11-12-9-7-8-10-14(12)17-15/h7-11,13H,5-6H2,1-4H3