(2Z)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[4-(hydroxymethyl)phenyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione

Systemtic Name: (2Z)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[4-(hydroxymethyl)phenyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Openeye Name: (2Z)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[4-(hydroxymethyl)phenyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione CAS Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[4-(hydroxymethyl)phenyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione IUPAC Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[4-(hydroxymethyl)phenyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Traditional Name: (2Z)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-(4-methylolphenyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Formula: C28H28N2O8 MolecularWeight: 520.53052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=O)C(=C(N)O)C1=O)O)O)O)C5=CC=C(C=C5)CO

Isomeric SMILES

CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=O)/C(=C(/N)\O)/C1=O)O)O)O)C5=CC=C(C=C5)CO

InChI

InChI=1S/C28H28N2O8/c1-30(2)22-17-10-14-9-16-15(13-5-3-12(11-31)4-6-13)7-8-18(32)20(16)23(33)19(14)25(35)28(17,38)26(36)21(24(22)34)27(29)37/h3-8,14,17,22,31-33,37-38H,9-11,29H2,1-2H3/b27-21-