2-(2-chloranyl-5-nitro-phenyl)-4-[(3-ethoxy-4-propoxy-phenyl)methylidene]-1,3-oxazol-5-one

Systemtic Name: 2-(2-chloranyl-5-nitro-phenyl)-4-[(3-ethoxy-4-propoxy-phenyl)methylidene]-1,3-oxazol-5-one Openeye Name: 2-(2-chloro-5-nitro-phenyl)-4-[(3-ethoxy-4-propoxy-phenyl)methylene]oxazol-5-one CAS Name: 2-(2-chloro-5-nitrophenyl)-4-[(3-ethoxy-4-propoxyphenyl)methylidene]-5-oxazolone IUPAC Name: 2-(2-chloro-5-nitrophenyl)-4-[(3-ethoxy-4-propoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: 2-(2-chloro-5-nitro-phenyl)-4-(3-ethoxy-4-propoxy-benzylidene)-2-oxazolin-5-one Formula: C21H19ClN2O6 MolecularWeight: 430.83836

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OCC

InChI

InChI=1S/C21H19ClN2O6/c1-3-9-29-18-8-5-13(11-19(18)28-4-2)10-17-21(25)30-20(23-17)15-12-14(24(26)27)6-7-16(15)22/h5-8,10-12H,3-4,9H2,1-2H3