2-[(1R,5S)-6-methoxy-1,5-dinitro-3-azoniabicyclo[3.3.1]non-6-en-3-yl]ethanol

Systemtic Name: 2-[(1R,5S)-6-methoxy-1,5-dinitro-3-azoniabicyclo[3.3.1]non-6-en-3-yl]ethanol Openeye Name: 2-[(1R,5S)-6-methoxy-1,5-dinitro-3-azoniabicyclo[3.3.1]non-6-en-3-yl]ethanol CAS Name: 2-[(1R,5S)-6-methoxy-1,5-dinitro-3-azoniabicyclo[3.3.1]non-6-en-3-yl]ethanol IUPAC Name: 2-[(1R,5S)-6-methoxy-1,5-dinitro-3-azoniabicyclo[3.3.1]non-6-en-3-yl]ethanol Traditional Name: 2-[(1R,5S)-6-methoxy-1,5-dinitro-3-azoniabicyclo[3.3.1]non-6-en-3-yl]ethanol Formula: C11H18N3O6+ MolecularWeight: 288.27712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CCC2(CC1(C[NH+](C2)CCO)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC[C@]2(C[C@@]1(C[NH+](C2)CCO)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H17N3O6/c1-20-9-2-3-10(13(16)17)6-11(9,14(18)19)8-12(7-10)4-5-15/h2,15H,3-8H2,1H3/p+1/t10-,11+/m1/s1