4-nitro-N-phenethyl-2,1,3-benzoxadiazol-5-amine

Systemtic Name: 4-nitro-N-phenethyl-2,1,3-benzoxadiazol-5-amine Openeye Name: 4-nitro-N-phenethyl-2,1,3-benzoxadiazol-5-amine CAS Name: 4-nitro-N-phenethyl-2,1,3-benzoxadiazol-5-amine IUPAC Name: 4-nitro-N-phenethyl-2,1,3-benzoxadiazol-5-amine Traditional Name: (4-nitrobenzofurazan-5-yl)-phenethyl-amine Formula: C14H12N4O3 MolecularWeight: 284.27008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C(C3=NON=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C(C3=NON=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O3/c19-18(20)14-12(7-6-11-13(14)17-21-16-11)15-9-8-10-4-2-1-3-5-10/h1-7,15H,8-9H2