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

Systemtic Name: 5-(azepan-1-yl)-N-(4-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: 5-(azepan-1-yl)-N-(4-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: 5-(1-azepanyl)-N-(4-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: 5-(azepan-1-yl)-N-(4-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: [6-(azepan-1-yl)-7-nitro-benzofurazan-4-yl]-(4-fluorophenyl)amine Formula: C18H18FN5O3 MolecularWeight: 371.365623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18FN5O3/c19-12-5-7-13(8-6-12)20-14-11-15(23-9-3-1-2-4-10-23)18(24(25)26)17-16(14)21-27-22-17/h5-8,11,20H,1-4,9-10H2