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

Systemtic Name: 3-(5-hexylthiophen-2-yl)-5-(4-octylphenyl)-1,2-oxazole Openeye Name: 3-(5-hexyl-2-thienyl)-5-(4-octylphenyl)isoxazole CAS Name: 3-(5-hexyl-2-thiophenyl)-5-(4-octylphenyl)isoxazole IUPAC Name: 3-(5-hexylthiophen-2-yl)-5-(4-octylphenyl)-1,2-oxazole Traditional Name: 3-(5-hexyl-2-thienyl)-5-(4-octylphenyl)isoxazole Formula: C27H37NOS MolecularWeight: 423.65378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCCCC

InChI

InChI=1S/C27H37NOS/c1-3-5-7-9-10-11-13-22-15-17-23(18-16-22)26-21-25(28-29-26)27-20-19-24(30-27)14-12-8-6-4-2/h15-21H,3-14H2,1-2H3