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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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