4,5-bis(oxidanylidene)-3,6-bis[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate

Systemtic Name: 4,5-bis(oxidanylidene)-3,6-bis[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate Openeye Name: 4,5-dioxo-3,6-bis[(2-sulfonatophenyl)hydrazono]naphthalene-2,7-disulfonate CAS Name: 4,5-dioxo-3,6-bis[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate IUPAC Name: 4,5-dioxo-3,6-bis[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate Traditional Name: 4,5-diketo-3,6-bis[(2-sulfonatophenyl)hydrazono]naphthalene-2,7-disulfonate Formula: C22H12N4O14S4-4 MolecularWeight: 684.60908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC=CC=C4S(=O)(=O)[O-])C(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC=CC=C4S(=O)(=O)[O-])C(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C22H16N4O14S4/c27-21-18-11(9-16(43(35,36)37)19(21)25-23-12-5-1-3-7-14(12)41(29,30)31)10-17(44(38,39)40)20(22(18)28)26-24-13-6-2-4-8-15(13)42(32,33)34/h1-10,23-24H,(H,29,30,31)(H,32,33,34)(H,35,36,37)(H,38,39,40)/p-4