[5-[4-(4-pentylphenyl)phenyl]thiophen-2-yl] (E)-hept-2-enoate

Systemtic Name: [5-[4-(4-pentylphenyl)phenyl]thiophen-2-yl] (E)-hept-2-enoate Openeye Name: [5-[4-(4-pentylphenyl)phenyl]-2-thienyl] (E)-hept-2-enoate CAS Name: (E)-2-heptenoic acid [5-[4-(4-pentylphenyl)phenyl]-2-thiophenyl] ester IUPAC Name: [5-[4-(4-pentylphenyl)phenyl]thiophen-2-yl] (E)-hept-2-enoate Traditional Name: (E)-hept-2-enoic acid [5-[4-(4-amylphenyl)phenyl]-2-thienyl] ester Formula: C28H32O2S MolecularWeight: 432.61748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(S3)OC(=O)C=CCCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(S3)OC(=O)/C=C/CCCC

InChI

InChI=1S/C28H32O2S/c1-3-5-7-9-11-27(29)30-28-21-20-26(31-28)25-18-16-24(17-19-25)23-14-12-22(13-15-23)10-8-6-4-2/h9,11-21H,3-8,10H2,1-2H3/b11-9+