(1R,5S)-3-ethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene

Systemtic Name: (1R,5S)-3-ethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene Openeye Name: (1R,5S)-3-ethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene CAS Name: (1R,5S)-3-ethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene IUPAC Name: (1R,5S)-3-ethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene Traditional Name: (1R,5S)-3-ethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene Formula: C16H20N3O5+ MolecularWeight: 334.3471

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC2(CC=C(C(C2)(C1)[N+](=O)[O-])OC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1C[C@]2(CC=C([C@](C2)(C1)[N+](=O)[O-])OC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O5/c1-2-17-11-15(18(20)21)9-8-14(16(10-15,12-17)19(22)23)24-13-6-4-3-5-7-13/h3-8H,2,9-12H2,1H3/p+1/t15-,16+/m1/s1