N-[5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-yl]-N',N'-dimethyl-ethane-1,2-diamine

Systemtic Name: N-[5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-yl]-N',N'-dimethyl-ethane-1,2-diamine Openeye Name: N-[5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-yl]-N',N'-dimethyl-ethane-1,2-diamine CAS Name: N-[5-(1-azepanyl)-4-nitro-2,1,3-benzoxadiazol-7-yl]-N',N'-dimethylethane-1,2-diamine IUPAC Name: N-[5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-yl]-N',N'-dimethylethane-1,2-diamine Traditional Name: 2-[[6-(azepan-1-yl)-7-nitro-benzofurazan-4-yl]amino]ethyl-dimethyl-amine Formula: C16H24N6O3 MolecularWeight: 348.40016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC(=C(C2=NON=C12)[N+](=O)[O-])N3CCCCCC3

Isomeric SMILES

CN(C)CCNC1=CC(=C(C2=NON=C12)[N+](=O)[O-])N3CCCCCC3

InChI

InChI=1S/C16H24N6O3/c1-20(2)10-7-17-12-11-13(21-8-5-3-4-6-9-21)16(22(23)24)15-14(12)18-25-19-15/h11,17H,3-10H2,1-2H3