5-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine

Systemtic Name: 5-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine Openeye Name: N-benzyl-5-nitro-2,1,3-benzoxadiazol-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine IUPAC Name: N-benzyl-5-nitro-2,1,3-benzoxadiazol-4-amine Traditional Name: benzyl-(5-nitrobenzofurazan-4-yl)amine Formula: C13H10N4O3 MolecularWeight: 270.2435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=CC3=NON=C32)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=CC3=NON=C32)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O3/c18-17(19)11-7-6-10-12(16-20-15-10)13(11)14-8-9-4-2-1-3-5-9/h1-7,14H,8H2