4-fluoranyl-N-hexan-2-yl-3-nitro-aniline

Systemtic Name: 4-fluoranyl-N-hexan-2-yl-3-nitro-aniline Openeye Name: 4-fluoro-N-(1-methylpentyl)-3-nitro-aniline CAS Name: 4-fluoro-N-hexan-2-yl-3-nitroaniline IUPAC Name: 4-fluoro-N-hexan-2-yl-3-nitroaniline Traditional Name: (4-fluoro-3-nitro-phenyl)-(1-methylpentyl)amine Formula: C12H17FN2O2 MolecularWeight: 240.273983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC1=CC(=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

CCCCC(C)NC1=CC(=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C12H17FN2O2/c1-3-4-5-9(2)14-10-6-7-11(13)12(8-10)15(16)17/h6-9,14H,3-5H2,1-2H3