1,4-bis(azanyl)-9,10-bis(oxidanylidene)-3-phenoxy-anthracene-2-sulfonic acid

Systemtic Name: 1,4-bis(azanyl)-9,10-bis(oxidanylidene)-3-phenoxy-anthracene-2-sulfonic acid Openeye Name: 1,4-diamino-9,10-dioxo-3-phenoxy-anthracene-2-sulfonic acid CAS Name: 1,4-diamino-9,10-dioxo-3-phenoxy-2-anthracenesulfonic acid IUPAC Name: 1,4-diamino-9,10-dioxo-3-phenoxyanthracene-2-sulfonic acid Traditional Name: 1,4-diamino-9,10-diketo-3-phenoxy-anthracene-2-sulfonic acid Formula: C20H14N2O6S MolecularWeight: 410.39996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C3=C(C(=C2S(=O)(=O)O)N)C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C3=C(C(=C2S(=O)(=O)O)N)C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C20H14N2O6S/c21-15-13-14(18(24)12-9-5-4-8-11(12)17(13)23)16(22)20(29(25,26)27)19(15)28-10-6-2-1-3-7-10/h1-9H,21-22H2,(H,25,26,27)