tert-butyl-[(2S)-3-(5-methyl-2-nitro-phenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-3-(5-methyl-2-nitro-phenoxy)-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-3-(5-methyl-2-nitro-phenoxy)propyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-3-(5-methyl-2-nitrophenoxy)propyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-3-(5-methyl-2-nitrophenoxy)propyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-3-(5-methyl-2-nitro-phenoxy)propyl]ammonium Formula: C14H23N2O4+ MolecularWeight: 283.34342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(C[NH2+]C(C)(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OC[C@H](C[NH2+]C(C)(C)C)O

InChI

InChI=1S/C14H22N2O4/c1-10-5-6-12(16(18)19)13(7-10)20-9-11(17)8-15-14(2,3)4/h5-7,11,15,17H,8-9H2,1-4H3/p+1/t11-/m0/s1