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

Systemtic Name: 5-(azepan-1-yl)-4-fluoranyl-2-nitro-aniline Openeye Name: 5-(azepan-1-yl)-4-fluoro-2-nitro-aniline CAS Name: 5-(1-azepanyl)-4-fluoro-2-nitroaniline IUPAC Name: 5-(azepan-1-yl)-4-fluoro-2-nitroaniline Traditional Name: [5-(azepan-1-yl)-4-fluoro-2-nitro-phenyl]amine Formula: C12H16FN3O2 MolecularWeight: 253.272743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=C(C=C2F)[N+](=O)[O-])N

Isomeric SMILES

C1CCCN(CC1)C2=CC(=C(C=C2F)[N+](=O)[O-])N

InChI

InChI=1S/C12H16FN3O2/c13-9-7-12(16(17)18)10(14)8-11(9)15-5-3-1-2-4-6-15/h7-8H,1-6,14H2