(phenylmethyl) 3-dodecyl-5-(3-dodecylthiophen-2-yl)thiophene-2-carboxylate

Systemtic Name: (phenylmethyl) 3-dodecyl-5-(3-dodecylthiophen-2-yl)thiophene-2-carboxylate Openeye Name: benzyl 3-dodecyl-5-(3-dodecyl-2-thienyl)thiophene-2-carboxylate CAS Name: 3-dodecyl-5-(3-dodecyl-2-thiophenyl)-2-thiophenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-dodecyl-5-(3-dodecylthiophen-2-yl)thiophene-2-carboxylate Traditional Name: 3-lauryl-5-(3-lauryl-2-thienyl)thiophene-2-carboxylic acid benzyl ester Formula: C40H60O2S2 MolecularWeight: 637.0332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(SC=C1)C2=CC(=C(S2)C(=O)OCC3=CC=CC=C3)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=C(SC=C1)C2=CC(=C(S2)C(=O)OCC3=CC=CC=C3)CCCCCCCCCCCC

InChI

InChI=1S/C40H60O2S2/c1-3-5-7-9-11-13-15-17-19-24-28-35-30-31-43-38(35)37-32-36(29-25-20-18-16-14-12-10-8-6-4-2)39(44-37)40(41)42-33-34-26-22-21-23-27-34/h21-23,26-27,30-32H,3-20,24-25,28-29,33H2,1-2H3