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

Systemtic Name: 2-(2-chloranyl-4-nitro-phenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: 2-(2-chloro-4-nitro-phenyl)-4-[(2,4-dipropoxyphenyl)methylene]oxazol-5-one CAS Name: 2-(2-chloro-4-nitrophenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-5-oxazolone IUPAC Name: 2-(2-chloro-4-nitrophenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: 2-(2-chloro-4-nitro-phenyl)-4-(2,4-dipropoxybenzylidene)-2-oxazolin-5-one Formula: C22H21ClN2O6 MolecularWeight: 444.86494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN2O6/c1-3-9-29-16-7-5-14(20(13-16)30-10-4-2)11-19-22(26)31-21(24-19)17-8-6-15(25(27)28)12-18(17)23/h5-8,11-13H,3-4,9-10H2,1-2H3