[4-(4-methylhexoxy)phenyl] 5-dodecylthiophene-2-carboxylate

Systemtic Name: [4-(4-methylhexoxy)phenyl] 5-dodecylthiophene-2-carboxylate Openeye Name: [4-(4-methylhexoxy)phenyl] 5-dodecylthiophene-2-carboxylate CAS Name: 5-dodecyl-2-thiophenecarboxylic acid [4-(4-methylhexoxy)phenyl] ester IUPAC Name: [4-(4-methylhexoxy)phenyl] 5-dodecylthiophene-2-carboxylate Traditional Name: 5-laurylthiophene-2-carboxylic acid [4-(4-methylhexoxy)phenyl] ester Formula: C30H46O3S MolecularWeight: 486.74944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(S1)C(=O)OC2=CC=C(C=C2)OCCCC(C)CC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(S1)C(=O)OC2=CC=C(C=C2)OCCCC(C)CC

InChI

InChI=1S/C30H46O3S/c1-4-6-7-8-9-10-11-12-13-14-17-28-22-23-29(34-28)30(31)33-27-20-18-26(19-21-27)32-24-15-16-25(3)5-2/h18-23,25H,4-17,24H2,1-3H3