[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-[(3S)-2-oxidanylideneoxolan-3-yl]azanium

Systemtic Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-[(3S)-2-oxidanylideneoxolan-3-yl]azanium Openeye Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-[(3S)-2-oxotetrahydrofuran-3-yl]ammonium CAS Name: [(1S)-1-(4-methyl-3-nitrophenyl)ethyl]-[(3S)-2-oxo-3-oxolanyl]ammonium IUPAC Name: [(1S)-1-(4-methyl-3-nitrophenyl)ethyl]-[(3S)-2-oxooxolan-3-yl]azanium Traditional Name: [(3S)-2-ketotetrahydrofuran-3-yl]-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C13H17N2O4+ MolecularWeight: 265.28508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]C2CCOC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+][C@H]2CCOC2=O)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O4/c1-8-3-4-10(7-12(8)15(17)18)9(2)14-11-5-6-19-13(11)16/h3-4,7,9,11,14H,5-6H2,1-2H3/p+1/t9-,11-/m0/s1