3-bromanyl-6-hexoxy-2-(4-hexylphenyl)-1-benzothiophene

Systemtic Name: 3-bromanyl-6-hexoxy-2-(4-hexylphenyl)-1-benzothiophene Openeye Name: 3-bromo-6-hexoxy-2-(4-hexylphenyl)benzothiophene CAS Name: 3-bromo-6-hexoxy-2-(4-hexylphenyl)-1-benzothiophene IUPAC Name: 3-bromo-6-hexoxy-2-(4-hexylphenyl)-1-benzothiophene Traditional Name: 3-bromo-6-hexoxy-2-(4-hexylphenyl)benzothiophene Formula: C26H33BrOS MolecularWeight: 473.50862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OCCCCCC)Br

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OCCCCCC)Br

InChI

InChI=1S/C26H33BrOS/c1-3-5-7-9-11-20-12-14-21(15-13-20)26-25(27)23-17-16-22(19-24(23)29-26)28-18-10-8-6-4-2/h12-17,19H,3-11,18H2,1-2H3