tert-butyl-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: tert-butyl-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]ammonium Formula: C12H19N2O3+ MolecularWeight: 239.29086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(C1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@H](C1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C12H18N2O3/c1-12(2,3)13-8-11(15)9-4-6-10(7-5-9)14(16)17/h4-7,11,13,15H,8H2,1-3H3/p+1/t11-/m1/s1