(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl octanoate

Systemtic Name: (4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl octanoate Openeye Name: (4,5-diphenyloxazol-2-yl)sulfanyl octanoate CAS Name: octanoic acid [(4,5-diphenyl-2-oxazolyl)thio] ester IUPAC Name: (4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl octanoate Traditional Name: caprylic acid [(4,5-diphenyloxazol-2-yl)thio] ester Formula: C23H25NO3S MolecularWeight: 395.5145

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC(=O)OSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H25NO3S/c1-2-3-4-5-12-17-20(25)27-28-23-24-21(18-13-8-6-9-14-18)22(26-23)19-15-10-7-11-16-19/h6-11,13-16H,2-5,12,17H2,1H3