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

Systemtic Name: 5-(4-heptylphenyl)-3-(5-hexylthiophen-2-yl)-1,2-oxazole Openeye Name: 5-(4-heptylphenyl)-3-(5-hexyl-2-thienyl)isoxazole CAS Name: 5-(4-heptylphenyl)-3-(5-hexyl-2-thiophenyl)isoxazole IUPAC Name: 5-(4-heptylphenyl)-3-(5-hexylthiophen-2-yl)-1,2-oxazole Traditional Name: 5-(4-heptylphenyl)-3-(5-hexyl-2-thienyl)isoxazole Formula: C26H35NOS MolecularWeight: 409.6272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCCCC

InChI

InChI=1S/C26H35NOS/c1-3-5-7-9-10-12-21-14-16-22(17-15-21)25-20-24(27-28-25)26-19-18-23(29-26)13-11-8-6-4-2/h14-20H,3-13H2,1-2H3