N,N-dimethyl-1-thiophen-2-yl-methanamine; 2,4,6-trinitrophenol

Systemtic Name: N,N-dimethyl-1-thiophen-2-yl-methanamine; 2,4,6-trinitrophenol Openeye Name: N,N-dimethyl-1-(2-thienyl)methanamine; picric acid CAS Name: N,N-dimethyl-1-thiophen-2-ylmethanamine; 2,4,6-trinitrophenol IUPAC Name: N,N-dimethyl-1-thiophen-2-ylmethanamine; 2,4,6-trinitrophenol Traditional Name: dimethyl(2-thenyl)amine; picric acid Formula: C13H14N4O7S MolecularWeight: 370.33786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CS1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=CS1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H11NS.C6H3N3O7/c1-8(2)6-7-4-3-5-9-7;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-5H,6H2,1-2H3;1-2,10H