[(2S,3R)-2-ethoxycarbonyl-7,7-dimethyl-8-nitroso-4-oxidanidyl-2,3-dihydro-1H-pyrano[3,4-b]pyrazin-3-yl]azanium

Systemtic Name: [(2S,3R)-2-ethoxycarbonyl-7,7-dimethyl-8-nitroso-4-oxidanidyl-2,3-dihydro-1H-pyrano[3,4-b]pyrazin-3-yl]azanium Openeye Name: [(2S,3R)-2-ethoxycarbonyl-7,7-dimethyl-8-nitroso-4-oxido-2,3-dihydro-1H-pyrano[3,4-b]pyrazin-3-yl]ammonium CAS Name: [(2S,3R)-2-ethoxycarbonyl-7,7-dimethyl-8-nitroso-4-oxido-2,3-dihydro-1H-pyrano[3,4-b]pyrazin-3-yl]ammonium IUPAC Name: [(2S,3R)-2-ethoxycarbonyl-7,7-dimethyl-8-nitroso-4-oxido-2,3-dihydro-1H-pyrano[3,4-b]pyrazin-3-yl]azanium Traditional Name: [(2S,3R)-2-carbethoxy-7,7-dimethyl-8-nitroso-4-oxido-2,3-dihydro-1H-pyrano[3,4-b]pyrazin-3-yl]ammonium Formula: C12H18N4O5 MolecularWeight: 298.29512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N(C2=COC(C(=C2N1)N=O)(C)C)[O-])[NH3+]

Isomeric SMILES

CCOC(=O)[C@@H]1[C@@H](N(C2=COC(C(=C2N1)N=O)(C)C)[O-])[NH3+]

InChI

InChI=1S/C12H17N4O5/c1-4-20-11(17)8-10(13)16(19)6-5-21-12(2,3)9(15-18)7(6)14-8/h5,8,10,14H,4,13H2,1-3H3/q-1/p+1/t8-,10+/m0/s1