2-methyl-1-(2-methylphenoxy)propan-2-amine; 2,4,6-trinitrophenol

Systemtic Name: 2-methyl-1-(2-methylphenoxy)propan-2-amine; 2,4,6-trinitrophenol Openeye Name: 2-methyl-1-(2-methylphenoxy)propan-2-amine; picric acid CAS Name: 2-methyl-1-(2-methylphenoxy)-2-propanamine; 2,4,6-trinitrophenol IUPAC Name: 2-methyl-1-(2-methylphenoxy)propan-2-amine; 2,4,6-trinitrophenol Traditional Name: [1,1-dimethyl-2-(2-methylphenoxy)ethyl]amine; picric acid Formula: C17H20N4O8 MolecularWeight: 408.3627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(C)(C)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCC(C)(C)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H17NO.C6H3N3O7/c1-9-6-4-5-7-10(9)13-8-11(2,3)12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-7H,8,12H2,1-3H3;1-2,10H