4-[(4-nitrophenyl)methyl]-3-phenyl-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 4-[(4-nitrophenyl)methyl]-3-phenyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-[(4-nitrophenyl)methyl]-3-phenyl-oxadiazol-3-ium-5-olate CAS Name: 4-[(4-nitrophenyl)methyl]-3-phenyl-5-oxadiazol-3-iumolate IUPAC Name: 4-[(4-nitrophenyl)methyl]-3-phenyloxadiazol-3-ium-5-olate Traditional Name: 4-(4-nitrobenzyl)-3-phenyl-oxadiazol-3-ium-5-olate Formula: C15H11N3O4 MolecularWeight: 297.26554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=NOC(=C2CC3=CC=C(C=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=NOC(=C2CC3=CC=C(C=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C15H11N3O4/c19-15-14(10-11-6-8-13(9-7-11)18(20)21)17(16-22-15)12-4-2-1-3-5-12/h1-9H,10H2