[(2S)-butan-2-yl]-[2-(4-nitrophenoxy)ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[2-(4-nitrophenoxy)ethyl]azanium Openeye Name: [(1S)-1-methylpropyl]-[2-(4-nitrophenoxy)ethyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-(4-nitrophenoxy)ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-(4-nitrophenoxy)ethyl]azanium Traditional Name: [(1S)-1-methylpropyl]-[2-(4-nitrophenoxy)ethyl]ammonium Formula: C12H19N2O3+ MolecularWeight: 239.29086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)[NH2+]CCOC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O3/c1-3-10(2)13-8-9-17-12-6-4-11(5-7-12)14(15)16/h4-7,10,13H,3,8-9H2,1-2H3/p+1/t10-/m0/s1