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

Systemtic Name: 2-(4-butoxyphenyl)-4-[[(3-chloranyl-4-methoxy-phenyl)amino]methylidene]-1,3-oxazol-5-one Openeye Name: 2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxy-anilino)methylene]oxazol-5-one CAS Name: 2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxyanilino)methylidene]-5-oxazolone IUPAC Name: 2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxyanilino)methylidene]-1,3-oxazol-5-one Traditional Name: 2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxy-anilino)methylene]-2-oxazolin-5-one Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O4/c1-3-4-11-27-16-8-5-14(6-9-16)20-24-18(21(25)28-20)13-23-15-7-10-19(26-2)17(22)12-15/h5-10,12-13,23H,3-4,11H2,1-2H3