(4-heptylphenyl) 2-propylthieno[2,3-b]thiophene-5-carboxylate

Systemtic Name: (4-heptylphenyl) 2-propylthieno[2,3-b]thiophene-5-carboxylate Openeye Name: (4-heptylphenyl) 2-propylthieno[2,3-b]thiophene-5-carboxylate CAS Name: 2-propyl-5-thieno[2,3-b]thiophenecarboxylic acid (4-heptylphenyl) ester IUPAC Name: (4-heptylphenyl) 2-propylthieno[2,3-b]thiophene-5-carboxylate Traditional Name: 2-propylthieno[2,3-b]thiophene-5-carboxylic acid (4-heptylphenyl) ester Formula: C23H28O2S2 MolecularWeight: 400.59722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC3=C(S2)SC(=C3)CCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC3=C(S2)SC(=C3)CCC

InChI

InChI=1S/C23H28O2S2/c1-3-5-6-7-8-10-17-11-13-19(14-12-17)25-22(24)21-16-18-15-20(9-4-2)26-23(18)27-21/h11-16H,3-10H2,1-2H3