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

Systemtic Name: (4Z)-2-(4-chloranyl-3-nitro-phenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(4-chloro-3-nitro-phenyl)-4-[(4-octoxyphenyl)methylene]oxazol-5-one CAS Name: (4Z)-2-(4-chloro-3-nitrophenyl)-4-[(4-octoxyphenyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(4-chloro-3-nitrophenyl)-4-[(4-octoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(4-chloro-3-nitro-phenyl)-4-(4-octoxybenzylidene)-2-oxazolin-5-one Formula: C24H25ClN2O5 MolecularWeight: 456.9187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)/C=C\2/C(=O)OC(=N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H25ClN2O5/c1-2-3-4-5-6-7-14-31-19-11-8-17(9-12-19)15-21-24(28)32-23(26-21)18-10-13-20(25)22(16-18)27(29)30/h8-13,15-16H,2-7,14H2,1H3/b21-15-