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

Systemtic Name: 2-(2-chloranyl-5-nitro-phenyl)-4-[(3,4-diethoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: 2-(2-chloro-5-nitro-phenyl)-4-[(3,4-diethoxyphenyl)methylene]oxazol-5-one CAS Name: 2-(2-chloro-5-nitrophenyl)-4-[(3,4-diethoxyphenyl)methylidene]-5-oxazolone IUPAC Name: 2-(2-chloro-5-nitrophenyl)-4-[(3,4-diethoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: 2-(2-chloro-5-nitro-phenyl)-4-(3,4-diethoxybenzylidene)-2-oxazolin-5-one Formula: C20H17ClN2O6 MolecularWeight: 416.81178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OCC

InChI

InChI=1S/C20H17ClN2O6/c1-3-27-17-8-5-12(10-18(17)28-4-2)9-16-20(24)29-19(22-16)14-11-13(23(25)26)6-7-15(14)21/h5-11H,3-4H2,1-2H3