tetrasodium 7-oxidanyl-8-[2-(2-oxidanylidene-4-sulfonato-naphthalen-1-ylidene)hydrazinyl]naphthalene-1,3,6-trisulfonate

Systemtic Name: tetrasodium 7-oxidanyl-8-[2-(2-oxidanylidene-4-sulfonato-naphthalen-1-ylidene)hydrazinyl]naphthalene-1,3,6-trisulfonate Openeye Name: tetrasodium 7-hydroxy-8-[2-(2-oxo-4-sulfonato-1-naphthylidene)hydrazino]naphthalene-1,3,6-trisulfonate CAS Name: tetrasodium 7-hydroxy-8-[2-(2-oxo-4-sulfonato-1-naphthalenylidene)hydrazinyl]naphthalene-1,3,6-trisulfonate IUPAC Name: tetrasodium 7-hydroxy-8-[2-(2-oxo-4-sulfonatonaphthalen-1-ylidene)hydrazinyl]naphthalene-1,3,6-trisulfonate Traditional Name: tetrasodium 7-hydroxy-8-[N'-(2-keto-4-sulfonato-1-naphthylidene)hydrazino]naphthalene-1,3,6-trisulfonate Formula: C20H10N2Na4O14S4 MolecularWeight: 722.51748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)C2=NNC3=C(C(=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)C2=NNC3=C(C(=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C20H14N2O14S4.4Na/c23-13-8-14(38(28,29)30)11-3-1-2-4-12(11)18(13)21-22-19-17-9(6-16(20(19)24)40(34,35)36)5-10(37(25,26)27)7-15(17)39(31,32)33;;;;/h1-8,22,24H,(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36);;;;/q;4*+1/p-4