3-nitro-4-(1,2-oxazol-5-ylmethoxy)benzaldehyde

Systemtic Name: 3-nitro-4-(1,2-oxazol-5-ylmethoxy)benzaldehyde Openeye Name: 4-(isoxazol-5-ylmethoxy)-3-nitro-benzaldehyde CAS Name: 4-(5-isoxazolylmethoxy)-3-nitrobenzaldehyde IUPAC Name: 3-nitro-4-(1,2-oxazol-5-ylmethoxy)benzaldehyde Traditional Name: 4-(isoxazol-5-ylmethoxy)-3-nitro-benzaldehyde Formula: C11H8N2O5 MolecularWeight: 248.19162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=O)[N+](=O)[O-])OCC2=CC=NO2

Isomeric SMILES

C1=CC(=C(C=C1C=O)[N+](=O)[O-])OCC2=CC=NO2

InChI

InChI=1S/C11H8N2O5/c14-6-8-1-2-11(10(5-8)13(15)16)17-7-9-3-4-12-18-9/h1-6H,7H2