4-[(4-butoxy-3-methoxy-phenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[(4-butoxy-3-methoxy-phenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Openeye Name: 4-[(4-butoxy-3-methoxy-phenyl)methylene]-2-(3-nitrophenyl)oxazol-5-one CAS Name: 4-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-5-oxazolone IUPAC Name: 4-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: 4-(4-butoxy-3-methoxy-benzylidene)-2-(3-nitrophenyl)-2-oxazolin-5-one Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H20N2O6/c1-3-4-10-28-18-9-8-14(12-19(18)27-2)11-17-21(24)29-20(22-17)15-6-5-7-16(13-15)23(25)26/h5-9,11-13H,3-4,10H2,1-2H3