(2S)-1-(tert-butylamino)-3-(3-methyl-4-nitro-phenoxy)propan-2-ol

Systemtic Name: (2S)-1-(tert-butylamino)-3-(3-methyl-4-nitro-phenoxy)propan-2-ol Openeye Name: (2S)-1-(tert-butylamino)-3-(3-methyl-4-nitro-phenoxy)propan-2-ol CAS Name: (2S)-1-(tert-butylamino)-3-(3-methyl-4-nitrophenoxy)-2-propanol IUPAC Name: (2S)-1-(tert-butylamino)-3-(3-methyl-4-nitrophenoxy)propan-2-ol Traditional Name: (2S)-1-(tert-butylamino)-3-(3-methyl-4-nitro-phenoxy)propan-2-ol Formula: C14H22N2O4 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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