[2-[3-nitro-4-(6-sulfo-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl] sulfite

Systemtic Name: [2-[3-nitro-4-(6-sulfo-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl] sulfite Openeye Name: [2-[3-nitro-4-(6-sulfo-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl] sulfite CAS Name: [2-[3-nitro-4-(6-sulfo-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl] sulfite IUPAC Name: [2-[3-nitro-4-(6-sulfo-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl] sulfite Traditional Name: [2-[3-nitro-4-(6-sulfo-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl] sulfite Formula: C20H12N5O8S2- MolecularWeight: 514.46798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NC3=C(N2)C=C(C=C3)OS(=O)[O-])[N+](=O)[O-])C4=NC5=C(N4)C=C(C=C5)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=NC3=C(N2)C=C(C=C3)OS(=O)[O-])[N+](=O)[O-])C4=NC5=C(N4)C=C(C=C5)S(=O)(=O)O

InChI

InChI=1S/C20H13N5O8S2/c26-25(27)18-7-10(19-21-14-5-2-11(33-34(28)29)8-16(14)23-19)1-4-13(18)20-22-15-6-3-12(35(30,31)32)9-17(15)24-20/h1-9H,(H,21,23)(H,22,24)(H,28,29)(H,30,31,32)/p-1