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

Systemtic Name: 4-[[(2-bromanyl-4-methyl-phenyl)amino]methylidene]-2-(4-butoxyphenyl)-1,3-oxazol-5-one Openeye Name: 4-[(2-bromo-4-methyl-anilino)methylene]-2-(4-butoxyphenyl)oxazol-5-one CAS Name: 4-[(2-bromo-4-methylanilino)methylidene]-2-(4-butoxyphenyl)-5-oxazolone IUPAC Name: 4-[(2-bromo-4-methylanilino)methylidene]-2-(4-butoxyphenyl)-1,3-oxazol-5-one Traditional Name: 4-[(2-bromo-4-methyl-anilino)methylene]-2-(4-butoxyphenyl)-2-oxazolin-5-one Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC(=CNC3=C(C=C(C=C3)C)Br)C(=O)O2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC(=CNC3=C(C=C(C=C3)C)Br)C(=O)O2

InChI

InChI=1S/C21H21BrN2O3/c1-3-4-11-26-16-8-6-15(7-9-16)20-24-19(21(25)27-20)13-23-18-10-5-14(2)12-17(18)22/h5-10,12-13,23H,3-4,11H2,1-2H3