2-(4-chlorophenyl)-4,5-dihydro-1,3-thiazole; 2,4,6-trinitrophenol

Systemtic Name: 2-(4-chlorophenyl)-4,5-dihydro-1,3-thiazole; 2,4,6-trinitrophenol Openeye Name: 2-(4-chlorophenyl)-4,5-dihydrothiazole; picric acid CAS Name: 2-(4-chlorophenyl)-4,5-dihydrothiazole; 2,4,6-trinitrophenol IUPAC Name: 2-(4-chlorophenyl)-4,5-dihydro-1,3-thiazole; 2,4,6-trinitrophenol Traditional Name: 2-(4-chlorophenyl)-2-thiazoline; picric acid Formula: C15H11ClN4O7S MolecularWeight: 426.78844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)C2=CC=C(C=C2)Cl.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CSC(=N1)C2=CC=C(C=C2)Cl.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H8ClNS.C6H3N3O7/c10-8-3-1-7(2-4-8)9-11-5-6-12-9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-4H,5-6H2;1-2,10H