7-(azepan-1-yl)-N-methyl-4-nitro-N-phenyl-2,1,3-benzoxadiazol-5-amine

Systemtic Name: 7-(azepan-1-yl)-N-methyl-4-nitro-N-phenyl-2,1,3-benzoxadiazol-5-amine Openeye Name: 7-(azepan-1-yl)-N-methyl-4-nitro-N-phenyl-2,1,3-benzoxadiazol-5-amine CAS Name: 7-(1-azepanyl)-N-methyl-4-nitro-N-phenyl-2,1,3-benzoxadiazol-5-amine IUPAC Name: 7-(azepan-1-yl)-N-methyl-4-nitro-N-phenyl-2,1,3-benzoxadiazol-5-amine Traditional Name: [7-(azepan-1-yl)-4-nitro-benzofurazan-5-yl]-methyl-phenyl-amine Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=C(C3=NON=C3C(=C2)N4CCCCCC4)[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C2=C(C3=NON=C3C(=C2)N4CCCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O3/c1-22(14-9-5-4-6-10-14)16-13-15(23-11-7-2-3-8-12-23)17-18(21-27-20-17)19(16)24(25)26/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3