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

Systemtic Name: [(1S)-1-(3-methyl-5-nitro-phenyl)hexyl]azanium Openeye Name: [(1S)-1-(3-methyl-5-nitro-phenyl)hexyl]ammonium CAS Name: [(1S)-1-(3-methyl-5-nitrophenyl)hexyl]ammonium IUPAC Name: [(1S)-1-(3-methyl-5-nitrophenyl)hexyl]azanium Traditional Name: [(1S)-1-(3-methyl-5-nitro-phenyl)hexyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O2/c1-3-4-5-6-13(14)11-7-10(2)8-12(9-11)15(16)17/h7-9,13H,3-6,14H2,1-2H3/p+1/t13-/m0/s1