disodium 4-[[2,4-bis(azanyl)-3-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]benzenesulfonate

Systemtic Name: disodium 4-[[2,4-bis(azanyl)-3-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]benzenesulfonate Openeye Name: disodium 4-[2,4-diamino-3-(4-sulfonatophenyl)azo-phenyl]azobenzenesulfonate CAS Name: disodium 4-[2,4-diamino-3-(4-sulfonatophenyl)azophenyl]azobenzenesulfonate IUPAC Name: disodium 4-[[2,4-diamino-3-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]benzenesulfonate Traditional Name: disodium 4-[2,4-diamino-3-(4-sulfonatophenyl)azo-phenyl]azobesylate Formula: C18H14N6Na2O6S2 MolecularWeight: 520.4499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=C(C(=C(C=C2)N)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N=NC2=C(C(=C(C=C2)N)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C18H16N6O6S2.2Na/c19-15-9-10-16(23-21-11-1-5-13(6-2-11)31(25,26)27)17(20)18(15)24-22-12-3-7-14(8-4-12)32(28,29)30;;/h1-10H,19-20H2,(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2