3-(4-azido-3-nitro-phenyl)propanethial

Systemtic Name: 3-(4-azido-3-nitro-phenyl)propanethial Openeye Name: 3-(4-azido-3-nitro-phenyl)propanethial CAS Name: 3-(4-azido-3-nitrophenyl)propanethial IUPAC Name: 3-(4-azido-3-nitrophenyl)propanethial Traditional Name: 3-(4-azido-3-nitro-phenyl)thiopropionaldehyde Formula: C9H8N4O2S MolecularWeight: 236.25042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC=S)[N+](=O)[O-])N=[N+]=[N-]

Isomeric SMILES

C1=CC(=C(C=C1CCC=S)[N+](=O)[O-])N=[N+]=[N-]

InChI

InChI=1S/C9H8N4O2S/c10-12-11-8-4-3-7(2-1-5-16)6-9(8)13(14)15/h3-6H,1-2H2