trisodium (8Z)-7-oxidanylidene-8-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-1,3-disulfonate

Systemtic Name: trisodium (8Z)-7-oxidanylidene-8-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-1,3-disulfonate Openeye Name: trisodium (8Z)-7-oxo-8-[[4-(4-sulfonatophenyl)azophenyl]hydrazono]naphthalene-1,3-disulfonate CAS Name: trisodium (8Z)-7-oxo-8-[[4-(4-sulfonatophenyl)azophenyl]hydrazinylidene]naphthalene-1,3-disulfonate IUPAC Name: trisodium (8Z)-7-oxo-8-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-1,3-disulfonate Traditional Name: trisodium (8Z)-7-keto-8-[[4-(4-sulfonatophenyl)azophenyl]hydrazono]naphthalene-1,3-disulfonate Formula: C22H13N4Na3O10S3 MolecularWeight: 658.52373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C(=O)C=CC3=CC(=CC(=C32)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N/N=C/2\C(=O)C=CC3=CC(=CC(=C32)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C22H16N4O10S3.3Na/c27-19-10-1-13-11-18(38(31,32)33)12-20(39(34,35)36)21(13)22(19)26-25-15-4-2-14(3-5-15)23-24-16-6-8-17(9-7-16)37(28,29)30;;;/h1-12,25H,(H,28,29,30)(H,31,32,33)(H,34,35,36);;;/q;3*+1/p-3/b24-23?,26-22+;;;