3-nitroquinoline-2,4-disulfonic acid

Systemtic Name: 3-nitroquinoline-2,4-disulfonic acid Openeye Name: 3-nitroquinoline-2,4-disulfonic acid CAS Name: 3-nitroquinoline-2,4-disulfonic acid IUPAC Name: 3-nitroquinoline-2,4-disulfonic acid Traditional Name: 3-nitroquinoline-2,4-disulfonic acid Formula: C9H6N2O8S2 MolecularWeight: 334.28254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=N2)S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=N2)S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C9H6N2O8S2/c12-11(13)7-8(20(14,15)16)5-3-1-2-4-6(5)10-9(7)21(17,18)19/h1-4H,(H,14,15,16)(H,17,18,19)