N,4,6-trimethylpyridin-2-amine; 2,4,6-trinitrophenol

Systemtic Name: N,4,6-trimethylpyridin-2-amine; 2,4,6-trinitrophenol Openeye Name: picric acid; N,4,6-trimethylpyridin-2-amine CAS Name: N,4,6-trimethyl-2-pyridinamine; 2,4,6-trinitrophenol IUPAC Name: N,4,6-trimethylpyridin-2-amine; 2,4,6-trinitrophenol Traditional Name: (4,6-dimethyl-2-pyridyl)-methyl-amine; picric acid Formula: C14H15N5O7 MolecularWeight: 365.2982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12N2.C6H3N3O7/c1-6-4-7(2)10-8(5-6)9-3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-5H,1-3H3,(H,9,10);1-2,10H