quinoline-8-sulfonic acid; sodium; 2,4,6-trinitrophenol

Systemtic Name: quinoline-8-sulfonic acid; sodium; 2,4,6-trinitrophenol Openeye Name: picric acid; quinoline-8-sulfonic acid; sodium CAS Name: 8-quinolinesulfonic acid; sodium; 2,4,6-trinitrophenol IUPAC Name: quinoline-8-sulfonic acid; sodium; 2,4,6-trinitrophenol Traditional Name: picric acid; quinoline-8-sulfonic acid; sodium Formula: C15H10N4NaO10S MolecularWeight: 461.31547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)O)N=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].[Na]

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)O)N=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].[Na]

InChI

InChI=1S/C9H7NO3S.C6H3N3O7.Na/c11-14(12,13)8-5-1-3-7-4-2-6-10-9(7)8;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;/h1-6H,(H,11,12,13);1-2,10H;