4-[(Z)-[2-(3-nitrophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-[2-(3-nitrophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzenecarbonitrile Openeye Name: 4-[(Z)-[2-(3-nitrophenyl)-5-oxo-oxazol-4-ylidene]methyl]benzonitrile CAS Name: 4-[(Z)-[2-(3-nitrophenyl)-5-oxo-4-oxazolylidene]methyl]benzonitrile IUPAC Name: 4-[(Z)-[2-(3-nitrophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]benzonitrile Traditional Name: 4-[(Z)-[5-keto-2-(3-nitrophenyl)-2-oxazolin-4-ylidene]methyl]benzonitrile Formula: C17H9N3O4 MolecularWeight: 319.27106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC(=CC3=CC=C(C=C3)C#N)C(=O)O2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=N/C(=C\C3=CC=C(C=C3)C#N)/C(=O)O2

InChI

InChI=1S/C17H9N3O4/c18-10-12-6-4-11(5-7-12)8-15-17(21)24-16(19-15)13-2-1-3-14(9-13)20(22)23/h1-9H/b15-8-