[(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-nitrophenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-nitrophenyl)ethyl]azanium Openeye Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-nitrophenyl)ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-2-(2-nitrophenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-nitrophenyl)ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-nitrophenyl)ethyl]ammonium Formula: C15H25N3O2+2 MolecularWeight: 279.3779

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1C(C[NH3+])C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC[C@H]1CCCC[NH+]1[C@@H](C[NH3+])C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O2/c1-2-12-7-5-6-10-17(12)15(11-16)13-8-3-4-9-14(13)18(19)20/h3-4,8-9,12,15H,2,5-7,10-11,16H2,1H3/p+2/t12-,15-/m0/s1