(4Z)-2-(4-butoxyphenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4Z)-2-(4-butoxyphenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(4-butoxyphenyl)-4-[(4-octoxyphenyl)methylene]oxazol-5-one CAS Name: (4Z)-2-(4-butoxyphenyl)-4-[(4-octoxyphenyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(4-butoxyphenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(4-butoxyphenyl)-4-(4-octoxybenzylidene)-2-oxazolin-5-one Formula: C28H35NO4 MolecularWeight: 449.5818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)/C=C\2/C(=O)OC(=N2)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C28H35NO4/c1-3-5-7-8-9-10-20-32-24-15-11-22(12-16-24)21-26-28(30)33-27(29-26)23-13-17-25(18-14-23)31-19-6-4-2/h11-18,21H,3-10,19-20H2,1-2H3/b26-21-