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

Systemtic Name: (4-methoxy-3-nitro-phenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium Openeye Name: (4-methoxy-3-nitro-phenyl)methyl-[(3S)-2-oxotetrahydrofuran-3-yl]ammonium CAS Name: (4-methoxy-3-nitrophenyl)methyl-[(3S)-2-oxo-3-oxolanyl]ammonium IUPAC Name: (4-methoxy-3-nitrophenyl)methyl-[(3S)-2-oxooxolan-3-yl]azanium Traditional Name: [(3S)-2-ketotetrahydrofuran-3-yl]-(4-methoxy-3-nitro-benzyl)ammonium Formula: C12H15N2O5+ MolecularWeight: 267.2579

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]C2CCOC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+][C@H]2CCOC2=O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5/c1-18-11-3-2-8(6-10(11)14(16)17)7-13-9-4-5-19-12(9)15/h2-3,6,9,13H,4-5,7H2,1H3/p+1/t9-/m0/s1