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

Systemtic Name: (4Z)-2-(3-bromanyl-4-methoxy-phenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(3-bromo-4-methoxy-phenyl)-4-[(4-octoxyphenyl)methylene]oxazol-5-one CAS Name: (4Z)-2-(3-bromo-4-methoxyphenyl)-4-[(4-octoxyphenyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(3-bromo-4-methoxyphenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(3-bromo-4-methoxy-phenyl)-4-(4-octoxybenzylidene)-2-oxazolin-5-one Formula: C25H28BrNO4 MolecularWeight: 486.39812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28BrNO4/c1-3-4-5-6-7-8-15-30-20-12-9-18(10-13-20)16-22-25(28)31-24(27-22)19-11-14-23(29-2)21(26)17-19/h9-14,16-17H,3-8,15H2,1-2H3/b22-16-