[(2S)-2-(diethylamino)-2-(4-nitrophenyl)ethyl]azanium

Systemtic Name: [(2S)-2-(diethylamino)-2-(4-nitrophenyl)ethyl]azanium Openeye Name: [(2S)-2-(diethylamino)-2-(4-nitrophenyl)ethyl]ammonium CAS Name: [(2S)-2-(diethylamino)-2-(4-nitrophenyl)ethyl]ammonium IUPAC Name: [(2S)-2-(diethylamino)-2-(4-nitrophenyl)ethyl]azanium Traditional Name: [(2S)-2-(diethylamino)-2-(4-nitrophenyl)ethyl]ammonium Formula: C12H20N3O2+ MolecularWeight: 238.3061

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C[NH3+])C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)[C@H](C[NH3+])C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O2/c1-3-14(4-2)12(9-13)10-5-7-11(8-6-10)15(16)17/h5-8,12H,3-4,9,13H2,1-2H3/p+1/t12-/m1/s1