1-(tert-butylamino)-3-(4-methyl-2,3-dinitro-phenoxy)propan-2-ol

Systemtic Name: 1-(tert-butylamino)-3-(4-methyl-2,3-dinitro-phenoxy)propan-2-ol Openeye Name: 1-(tert-butylamino)-3-(4-methyl-2,3-dinitro-phenoxy)propan-2-ol CAS Name: 1-(tert-butylamino)-3-(4-methyl-2,3-dinitrophenoxy)-2-propanol IUPAC Name: 1-(tert-butylamino)-3-(4-methyl-2,3-dinitrophenoxy)propan-2-ol Traditional Name: 1-(tert-butylamino)-3-(4-methyl-2,3-dinitro-phenoxy)propan-2-ol Formula: C14H21N3O6 MolecularWeight: 327.33304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O6/c1-9-5-6-11(13(17(21)22)12(9)16(19)20)23-8-10(18)7-15-14(2,3)4/h5-6,10,15,18H,7-8H2,1-4H3