[(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-nitrophenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-nitrophenyl)ethyl]azanium Openeye Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-nitrophenyl)ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]-2-(4-nitrophenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-nitrophenyl)ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-nitrophenyl)ethyl]ammonium Formula: C14H23N3O2+2 MolecularWeight: 265.35132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1C(C[NH3+])C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2/c1-11-4-2-3-9-16(11)14(10-15)12-5-7-13(8-6-12)17(18)19/h5-8,11,14H,2-4,9-10,15H2,1H3/p+2/t11-,14-/m0/s1