3-(5-hexylthiophen-2-yl)-5-(4-nonylphenyl)-1,2-oxazole

Systemtic Name: 3-(5-hexylthiophen-2-yl)-5-(4-nonylphenyl)-1,2-oxazole Openeye Name: 3-(5-hexyl-2-thienyl)-5-(4-nonylphenyl)isoxazole CAS Name: 3-(5-hexyl-2-thiophenyl)-5-(4-nonylphenyl)isoxazole IUPAC Name: 3-(5-hexylthiophen-2-yl)-5-(4-nonylphenyl)-1,2-oxazole Traditional Name: 3-(5-hexyl-2-thienyl)-5-(4-nonylphenyl)isoxazole Formula: C28H39NOS MolecularWeight: 437.68036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCCCC

InChI

InChI=1S/C28H39NOS/c1-3-5-7-9-10-11-12-14-23-16-18-24(19-17-23)27-22-26(29-30-27)28-21-20-25(31-28)15-13-8-6-4-2/h16-22H,3-15H2,1-2H3