4-[[(2-bromanyl-4-methyl-phenyl)amino]methylidene]-2-(4-butylphenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[[(2-bromanyl-4-methyl-phenyl)amino]methylidene]-2-(4-butylphenyl)-1,3-oxazol-5-one Openeye Name: 4-[(2-bromo-4-methyl-anilino)methylene]-2-(4-butylphenyl)oxazol-5-one CAS Name: 4-[(2-bromo-4-methylanilino)methylidene]-2-(4-butylphenyl)-5-oxazolone IUPAC Name: 4-[(2-bromo-4-methylanilino)methylidene]-2-(4-butylphenyl)-1,3-oxazol-5-one Traditional Name: 4-[(2-bromo-4-methyl-anilino)methylene]-2-(4-butylphenyl)-2-oxazolin-5-one Formula: C21H21BrN2O2 MolecularWeight: 413.30764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC(=CNC3=C(C=C(C=C3)C)Br)C(=O)O2

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC(=CNC3=C(C=C(C=C3)C)Br)C(=O)O2

InChI

InChI=1S/C21H21BrN2O2/c1-3-4-5-15-7-9-16(10-8-15)20-24-19(21(25)26-20)13-23-18-11-6-14(2)12-17(18)22/h6-13,23H,3-5H2,1-2H3