N-[(9Z)-9-[azanyl(oxidanyl)methylidene]-7-(dimethylamino)-4-iodanyl-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-bromanyl-ethanamide; sulfuric acid

Systemtic Name: N-[(9Z)-9-[azanyl(oxidanyl)methylidene]-7-(dimethylamino)-4-iodanyl-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-bromanyl-ethanamide; sulfuric acid Openeye Name: N-[(9Z)-9-[amino(hydroxy)methylene]-7-(dimethylamino)-1,10a,12-trihydroxy-4-iodo-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-bromo-acetamide; sulfuric acid CAS Name: N-[(9Z)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-1,10a,12-trihydroxy-4-iodo-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-bromoacetamide; sulfuric acid IUPAC Name: N-[(9Z)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-1,10a,12-trihydroxy-4-iodo-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-bromoacetamide; sulfuric acid Traditional Name: N-[(9Z)-9-[amino(hydroxy)methylene]-7-(dimethylamino)-1,10a,12-trihydroxy-4-iodo-8,10,11-triketo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]-2-bromo-acetamide; sulfuric acid Formula: C23H25BrIN3O12S MolecularWeight: 774.33097

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C2CC3CC4=C(C=C(C(=C4C(=C3C(=O)C2(C(=O)C(=C(N)O)C1=O)O)O)O)NC(=O)CBr)I.OS(=O)(=O)O

Isomeric SMILES

CN(C)C1C2CC3CC4=C(C=C(C(=C4C(=C3C(=O)C2(C(=O)/C(=C(/N)\O)/C1=O)O)O)O)NC(=O)CBr)I.OS(=O)(=O)O

InChI

InChI=1S/C23H23BrIN3O8.H2O4S/c1-28(2)16-9-4-7-3-8-10(25)5-11(27-12(29)6-24)17(30)14(8)18(31)13(7)20(33)23(9,36)21(34)15(19(16)32)22(26)35;1-5(2,3)4/h5,7,9,16,30-31,35-36H,3-4,6,26H2,1-2H3,(H,27,29);(H2,1,2,3,4)/b22-15-;