3-(4-heptylphenyl)-5-(4-pentylphenyl)-1,2-oxazole

Systemtic Name: 3-(4-heptylphenyl)-5-(4-pentylphenyl)-1,2-oxazole Openeye Name: 3-(4-heptylphenyl)-5-(4-pentylphenyl)isoxazole CAS Name: 3-(4-heptylphenyl)-5-(4-pentylphenyl)isoxazole IUPAC Name: 3-(4-heptylphenyl)-5-(4-pentylphenyl)-1,2-oxazole Traditional Name: 5-(4-amylphenyl)-3-(4-heptylphenyl)isoxazole Formula: C27H35NO MolecularWeight: 389.5729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NOC(=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NOC(=C2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C27H35NO/c1-3-5-7-8-10-12-23-13-17-24(18-14-23)26-21-27(29-28-26)25-19-15-22(16-20-25)11-9-6-4-2/h13-21H,3-12H2,1-2H3