dilithium disodium 2-[[4-[(4-azanyl-5-sulfonato-naphthalen-1-yl)diazenyl]-7-sulfonato-naphthalen-1-yl]diazenyl]benzene-1,4-disulfonate

Systemtic Name: dilithium disodium 2-[[4-[(4-azanyl-5-sulfonato-naphthalen-1-yl)diazenyl]-7-sulfonato-naphthalen-1-yl]diazenyl]benzene-1,4-disulfonate Openeye Name: dilithium disodium 2-[[4-[(4-amino-5-sulfonato-1-naphthyl)azo]-7-sulfonato-1-naphthyl]azo]benzene-1,4-disulfonate CAS Name: dilithium disodium 2-[[4-[(4-amino-5-sulfonato-1-naphthalenyl)azo]-7-sulfonato-1-naphthalenyl]azo]benzene-1,4-disulfonate IUPAC Name: dilithium disodium 2-[[4-[(4-amino-5-sulfonatonaphthalen-1-yl)diazenyl]-7-sulfonatonaphthalen-1-yl]diazenyl]benzene-1,4-disulfonate Traditional Name: dilithium disodium 2-[[4-[(4-amino-5-sulfonato-1-naphthyl)azo]-7-sulfonato-1-naphthyl]azo]benzene-1,4-disulfonate Formula: C26H15Li2N5Na2O12S4 MolecularWeight: 777.54514

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)[O-])N)N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

[Li+].[Li+].C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)[O-])N)N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C26H19N5O12S4.2Li.2Na/c27-19-7-8-21(17-2-1-3-25(26(17)19)47(41,42)43)29-28-20-9-10-22(18-12-14(44(32,33)34)4-6-16(18)20)30-31-23-13-15(45(35,36)37)5-11-24(23)46(38,39)40;;;;/h1-13H,27H2,(H,32,33,34)(H,35,36,37)(H,38,39,40)(H,41,42,43);;;;/q;4*+1/p-4