[(2S,3S)-1-ethoxy-3-(3-nitrophenyl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-ethoxy-3-(3-nitrophenyl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S,2S)-1-ethoxycarbonyl-2-hydroxy-2-(3-nitrophenyl)ethyl]ammonium CAS Name: [(2S,3S)-1-ethoxy-3-hydroxy-3-(3-nitrophenyl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-ethoxy-3-hydroxy-3-(3-nitrophenyl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S,2S)-1-carbethoxy-2-hydroxy-2-(3-nitrophenyl)ethyl]ammonium Formula: C11H15N2O5+ MolecularWeight: 255.2472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O5/c1-2-18-11(15)9(12)10(14)7-4-3-5-8(6-7)13(16)17/h3-6,9-10,14H,2,12H2,1H3/p+1/t9-,10-/m0/s1