(4-butylphenyl) 2-nonylthieno[2,3-b]thiophene-5-carboxylate

Systemtic Name: (4-butylphenyl) 2-nonylthieno[2,3-b]thiophene-5-carboxylate Openeye Name: (4-butylphenyl) 2-nonylthieno[2,3-b]thiophene-5-carboxylate CAS Name: 2-nonyl-5-thieno[2,3-b]thiophenecarboxylic acid (4-butylphenyl) ester IUPAC Name: (4-butylphenyl) 2-nonylthieno[2,3-b]thiophene-5-carboxylate Traditional Name: 2-nonylthieno[2,3-b]thiophene-5-carboxylic acid (4-butylphenyl) ester Formula: C26H34O2S2 MolecularWeight: 442.67696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC2=C(S1)SC(=C2)C(=O)OC3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCCCCC1=CC2=C(S1)SC(=C2)C(=O)OC3=CC=C(C=C3)CCCC

InChI

InChI=1S/C26H34O2S2/c1-3-5-7-8-9-10-11-13-23-18-21-19-24(30-26(21)29-23)25(27)28-22-16-14-20(15-17-22)12-6-4-2/h14-19H,3-13H2,1-2H3