trisodium 4-hydroxy-5-{2-[4-(phenylamino)-5-sulfonatonaphthalen-1-yl]diazen-1-yl}naphthalene-2,7-disulfonate

CAS: 3861-73-2

Formula: C26H16N3Na3O10S3

SMILES: [Na+].[Na+].[Na+].OC1=C2C(=CC(=C1)S([O-])(=O)=O)C=C(C=C2N=NC1=CC=C(NC2=CC=CC=C2)C2=C(C=CC=C12)S([O-])(=O)=O)S([O-])(=O)=O

IUPAC: trisodium 4-hydroxy-5-{2-[4-(phenylamino)-5-sulfonatonaphthalen-1-yl]diazen-1-yl}naphthalene-2,7-disulfonate

InChI: InChI=1S/C26H19N3O10S3.3Na/c30-23-14-18(41(34,35)36)12-15-11-17(40(31,32)33)13-22(25(15)23)29-28-20-9-10-21(27-16-5-2-1-3-6-16)26-19(20)7-4-8-24(26)42(37,38)39;;;/h1-14,27,30H,(H,31,32,33)(H,34,35,36)(H,37,38,39);;;/q;3*+1/p-3

Composition: C (44.90%), H (2.32%), N (6.04%), Na (9.92%), O (23.00%), S (13.83%)

Molar Mass: 695.57

Atom Count: 61

Heavy Atom Count: 45