[(1S)-1-(3-chloranyl-5-nitro-phenyl)hexyl]azanium

Systemtic Name: [(1S)-1-(3-chloranyl-5-nitro-phenyl)hexyl]azanium Openeye Name: [(1S)-1-(3-chloro-5-nitro-phenyl)hexyl]ammonium CAS Name: [(1S)-1-(3-chloro-5-nitrophenyl)hexyl]ammonium IUPAC Name: [(1S)-1-(3-chloro-5-nitrophenyl)hexyl]azanium Traditional Name: [(1S)-1-(3-chloro-5-nitro-phenyl)hexyl]ammonium Formula: C12H18ClN2O2+ MolecularWeight: 257.73652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC(=CC(=C1)Cl)[N+](=O)[O-])[NH3+]

Isomeric SMILES

CCCCC[C@@H](C1=CC(=CC(=C1)Cl)[N+](=O)[O-])[NH3+]

InChI

InChI=1S/C12H17ClN2O2/c1-2-3-4-5-12(14)9-6-10(13)8-11(7-9)15(16)17/h6-8,12H,2-5,14H2,1H3/p+1/t12-/m0/s1