9,10-bis(oxidanylidene)-1,4-bis[(3-sulfophenyl)diazenyl]anthracene-2-sulfonic acid

Systemtic Name: 9,10-bis(oxidanylidene)-1,4-bis[(3-sulfophenyl)diazenyl]anthracene-2-sulfonic acid Openeye Name: 9,10-dioxo-1,4-bis[(3-sulfophenyl)azo]anthracene-2-sulfonic acid CAS Name: 9,10-dioxo-1,4-bis[(3-sulfophenyl)azo]-2-anthracenesulfonic acid IUPAC Name: 9,10-dioxo-1,4-bis[(3-sulfophenyl)diazenyl]anthracene-2-sulfonic acid Traditional Name: 9,10-diketo-1,4-bis[(3-sulfophenyl)azo]anthracene-2-sulfonic acid Formula: C26H16N4O11S3 MolecularWeight: 656.62044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3N=NC4=CC(=CC=C4)S(=O)(=O)O)S(=O)(=O)O)N=NC5=CC(=CC=C5)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3N=NC4=CC(=CC=C4)S(=O)(=O)O)S(=O)(=O)O)N=NC5=CC(=CC=C5)S(=O)(=O)O

InChI

InChI=1S/C26H16N4O11S3/c31-25-18-9-1-2-10-19(18)26(32)23-22(25)20(29-27-14-5-3-7-16(11-14)42(33,34)35)13-21(44(39,40)41)24(23)30-28-15-6-4-8-17(12-15)43(36,37)38/h1-13H,(H,33,34,35)(H,36,37,38)(H,39,40,41)