2-[[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzenesulfonic acid

Systemtic Name: 2-[[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzenesulfonic acid Openeye Name: 2-[(4-hydroxy-9,10-dioxo-1-anthryl)amino]benzenesulfonic acid CAS Name: 2-[(4-hydroxy-9,10-dioxo-1-anthracenyl)amino]benzenesulfonic acid IUPAC Name: 2-[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]benzenesulfonic acid Traditional Name: 2-[(4-hydroxy-9,10-diketo-1-anthryl)amino]besylic acid Formula: C20H13NO6S MolecularWeight: 395.38532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=CC=CC=C4S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=CC=CC=C4S(=O)(=O)O

InChI

InChI=1S/C20H13NO6S/c22-15-10-9-14(21-13-7-3-4-8-16(13)28(25,26)27)17-18(15)20(24)12-6-2-1-5-11(12)19(17)23/h1-10,21-22H,(H,25,26,27)