(2Z)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-6-methyl-6,10,11,12a-tetrakis(oxidanyl)-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione

Systemtic Name: (2Z)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-6-methyl-6,10,11,12a-tetrakis(oxidanyl)-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione Openeye Name: (2Z)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione CAS Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione IUPAC Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione Traditional Name: (2Z)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione Formula: C66H72N6O24 MolecularWeight: 1333.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)N(C)C)O.CC1(C2CC3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)N(C)C)O.CC1(C2CC3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)N(C)C)O

Isomeric SMILES

CC1(C2=C(C(=C3C1CC4C(C3=O)(C(=O)/C(=C(\O)/N)/C(=O)C4N(C)C)O)O)C(=CC=C2)O)O.CC1(C2=C(C(=C3C1CC4C(C3=O)(C(=O)/C(=C(\O)/N)/C(=O)C4N(C)C)O)O)C(=CC=C2)O)O.CC1(C2=C(C(=C3C1CC4C(C3=O)(C(=O)/C(=C(\O)/N)/C(=O)C4N(C)C)O)O)C(=CC=C2)O)O

InChI

InChI=1S/3C22H24N2O8/c3*1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h3*4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b3*20-14-