[(2S)-6-methylheptan-2-yl]-[(2-nitrophenyl)methyl]azanium

Systemtic Name: [(2S)-6-methylheptan-2-yl]-[(2-nitrophenyl)methyl]azanium Openeye Name: [(1S)-1,5-dimethylhexyl]-[(2-nitrophenyl)methyl]ammonium CAS Name: [(2S)-6-methylheptan-2-yl]-[(2-nitrophenyl)methyl]ammonium IUPAC Name: [(2S)-6-methylheptan-2-yl]-[(2-nitrophenyl)methyl]azanium Traditional Name: [(1S)-1,5-dimethylhexyl]-(2-nitrobenzyl)ammonium Formula: C15H25N2O2+ MolecularWeight: 265.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)[NH2+]CC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

C[C@@H](CCCC(C)C)[NH2+]CC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C15H24N2O2/c1-12(2)7-6-8-13(3)16-11-14-9-4-5-10-15(14)17(18)19/h4-5,9-10,12-13,16H,6-8,11H2,1-3H3/p+1/t13-/m0/s1