8-azanyl-5,7-bis(bromanyl)-9,10-bis(oxidanylidene)anthracene-1-sulfonic acid

Systemtic Name: 8-azanyl-5,7-bis(bromanyl)-9,10-bis(oxidanylidene)anthracene-1-sulfonic acid Openeye Name: 8-amino-5,7-dibromo-9,10-dioxo-anthracene-1-sulfonic acid CAS Name: 8-amino-5,7-dibromo-9,10-dioxo-1-anthracenesulfonic acid IUPAC Name: 8-amino-5,7-dibromo-9,10-dioxoanthracene-1-sulfonic acid Traditional Name: 8-amino-5,7-dibromo-9,10-diketo-anthracene-1-sulfonic acid Formula: C14H7Br2NO5S MolecularWeight: 461.08208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)C3=C(C2=O)C(=CC(=C3N)Br)Br

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)C3=C(C2=O)C(=CC(=C3N)Br)Br

InChI

InChI=1S/C14H7Br2NO5S/c15-6-4-7(16)12(17)11-10(6)13(18)5-2-1-3-8(23(20,21)22)9(5)14(11)19/h1-4H,17H2,(H,20,21,22)