2-[[7-sulfo-4-[[(8-sulfonaphthalen-1-yl)amino]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,7-disulfonic acid

Systemtic Name: 2-[[7-sulfo-4-[[(8-sulfonaphthalen-1-yl)amino]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,7-disulfonic acid Openeye Name: 2-[[7-sulfo-4-[(8-sulfo-1-naphthyl)amino]azo-1-naphthyl]azo]naphthalene-1,7-disulfonic acid CAS Name: 2-[[7-sulfo-4-[(8-sulfo-1-naphthalenyl)amino]azo-1-naphthalenyl]azo]naphthalene-1,7-disulfonic acid IUPAC Name: 2-[[7-sulfo-4-[[(8-sulfonaphthalen-1-yl)amino]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,7-disulfonic acid Traditional Name: 2-[[7-sulfo-4-[(8-sulfo-1-naphthyl)amino]azo-1-naphthyl]azo]naphthalene-1,7-disulfonic acid Formula: C30H21N5O12S4 MolecularWeight: 771.77404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NN=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C(C6=C(C=CC(=C6)S(=O)(=O)O)C=C5)S(=O)(=O)O)S(=O)(=O)O)C(=CC=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)NN=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C(C6=C(C=CC(=C6)S(=O)(=O)O)C=C5)S(=O)(=O)O)S(=O)(=O)O)C(=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C30H21N5O12S4/c36-48(37,38)19-9-7-17-8-12-27(30(22(17)15-19)51(45,46)47)32-31-25-14-13-24(21-11-10-20(16-23(21)25)49(39,40)41)33-35-34-26-5-1-3-18-4-2-6-28(29(18)26)50(42,43)44/h1-16H,(H,33,34)(H,36,37,38)(H,39,40,41)(H,42,43,44)(H,45,46,47)