5-(azepan-1-yl)-N,N-diethyl-2-fluoranyl-4-nitro-aniline

Systemtic Name: 5-(azepan-1-yl)-N,N-diethyl-2-fluoranyl-4-nitro-aniline Openeye Name: 5-(azepan-1-yl)-N,N-diethyl-2-fluoro-4-nitro-aniline CAS Name: 5-(1-azepanyl)-N,N-diethyl-2-fluoro-4-nitroaniline IUPAC Name: 5-(azepan-1-yl)-N,N-diethyl-2-fluoro-4-nitroaniline Traditional Name: [5-(azepan-1-yl)-2-fluoro-4-nitro-phenyl]-diethyl-amine Formula: C16H24FN3O2 MolecularWeight: 309.379063

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C(=C1)N2CCCCCC2)[N+](=O)[O-])F

Isomeric SMILES

CCN(CC)C1=C(C=C(C(=C1)N2CCCCCC2)[N+](=O)[O-])F

InChI

InChI=1S/C16H24FN3O2/c1-3-18(4-2)14-12-15(16(20(21)22)11-13(14)17)19-9-7-5-6-8-10-19/h11-12H,3-10H2,1-2H3