[4-[4-(5-octylthiophen-2-yl)phenyl]phenyl] (E)-but-2-enoate

Systemtic Name: [4-[4-(5-octylthiophen-2-yl)phenyl]phenyl] (E)-but-2-enoate Openeye Name: [4-[4-(5-octyl-2-thienyl)phenyl]phenyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [4-[4-(5-octyl-2-thiophenyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(5-octylthiophen-2-yl)phenyl]phenyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [4-[4-(5-octyl-2-thienyl)phenyl]phenyl] ester Formula: C28H32O2S MolecularWeight: 432.61748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C=CC

Isomeric SMILES

CCCCCCCCC1=CC=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)/C=C/C

InChI

InChI=1S/C28H32O2S/c1-3-5-6-7-8-9-11-26-20-21-27(31-26)24-14-12-22(13-15-24)23-16-18-25(19-17-23)30-28(29)10-4-2/h4,10,12-21H,3,5-9,11H2,1-2H3/b10-4+