3-[[oxidanidyl(phenyl)amino]diazenyl]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Systemtic Name: 3-[[oxidanidyl(phenyl)amino]diazenyl]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid Openeye Name: 3-(N-oxidoanilino)azo-9,10-dioxo-anthracene-2-sulfonic acid CAS Name: 3-(N-oxidoanilino)azo-9,10-dioxo-2-anthracenesulfonic acid IUPAC Name: 3-[(N-oxidoanilino)diazenyl]-9,10-dioxoanthracene-2-sulfonic acid Traditional Name: 9,10-diketo-3-(N-oxidoanilino)azo-anthracene-2-sulfonic acid Formula: C20H12N3O6S- MolecularWeight: 422.39078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(N=NC2=C(C=C3C(=C2)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(N=NC2=C(C=C3C(=C2)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O)[O-]

InChI

InChI=1S/C20H12N3O6S/c24-19-13-8-4-5-9-14(13)20(25)16-11-18(30(27,28)29)17(10-15(16)19)21-22-23(26)12-6-2-1-3-7-12/h1-11H,(H,27,28,29)/q-1