(4-heptoxyphenyl) 2-pentylthieno[2,3-b]thiophene-5-carboxylate

Systemtic Name: (4-heptoxyphenyl) 2-pentylthieno[2,3-b]thiophene-5-carboxylate Openeye Name: (4-heptoxyphenyl) 2-pentylthieno[2,3-b]thiophene-5-carboxylate CAS Name: 2-pentyl-5-thieno[2,3-b]thiophenecarboxylic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 2-pentylthieno[2,3-b]thiophene-5-carboxylate Traditional Name: 2-amylthieno[2,3-b]thiophene-5-carboxylic acid (4-heptoxyphenyl) ester Formula: C25H32O3S2 MolecularWeight: 444.64978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC3=C(S2)SC(=C3)CCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC3=C(S2)SC(=C3)CCCCC

InChI

InChI=1S/C25H32O3S2/c1-3-5-7-8-10-16-27-20-12-14-21(15-13-20)28-24(26)23-18-19-17-22(11-9-6-4-2)29-25(19)30-23/h12-15,17-18H,3-11,16H2,1-2H3