2-naphthalen-1-yl-4,6-dinitro-1-oxidanidyl-benzotriazol-1-ium

Systemtic Name: 2-naphthalen-1-yl-4,6-dinitro-1-oxidanidyl-benzotriazol-1-ium Openeye Name: 2-(1-naphthyl)-4,6-dinitro-1-oxido-benzotriazol-1-ium CAS Name: 2-(1-naphthalenyl)-4,6-dinitro-1-oxidobenzotriazol-1-ium IUPAC Name: 2-naphthalen-1-yl-4,6-dinitro-1-oxidobenzotriazol-1-ium Traditional Name: 2-(1-naphthyl)-4,6-dinitro-1-oxido-benzotriazol-1-ium Formula: C16H9N5O5 MolecularWeight: 351.27316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3N=C4C(=CC(=CC4=[N+]3[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3N=C4C(=CC(=CC4=[N+]3[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H9N5O5/c22-19-14-8-11(20(23)24)9-15(21(25)26)16(14)17-18(19)13-7-3-5-10-4-1-2-6-12(10)13/h1-9H