(2Z,4S,4aS,5aR,7E,12aS)-9-azanyl-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[1-[(2-methylpropan-2-yl)oxyamino]ethylidene]-11,12a-bis(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,10,12-tetrone

Systemtic Name: (2Z,4S,4aS,5aR,7E,12aS)-9-azanyl-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[1-[(2-methylpropan-2-yl)oxyamino]ethylidene]-11,12a-bis(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,10,12-tetrone Openeye Name: (2Z,4S,4aS,5aR,7E,12aS)-9-amino-2-[amino(hydroxy)methylene]-7-[1-(tert-butoxyamino)ethylidene]-4-(dimethylamino)-11,12a-dihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,10,12-tetrone CAS Name: (2Z,4S,4aS,5aR,7E,12aS)-9-amino-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-11,12a-dihydroxy-7-[1-[(2-methylpropan-2-yl)oxyamino]ethylidene]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,10,12-tetrone IUPAC Name: (2Z,4S,4aS,5aR,7E,12aS)-9-amino-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-11,12a-dihydroxy-7-[1-[(2-methylpropan-2-yl)oxyamino]ethylidene]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,10,12-tetrone Traditional Name: (2Z,4S,4aS,5aR,7E,12aS)-9-amino-2-[amino(hydroxy)methylene]-7-[1-(tert-butoxyamino)ethylidene]-4-(dimethylamino)-11,12a-dihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,10,12-diquinone Formula: C27H34N4O8 MolecularWeight: 542.58086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=C(C(=O)C2=C1CC3CC4C(C(=O)C(=C(N)O)C(=O)C4(C(=O)C3=C2O)O)N(C)C)N)NOC(C)(C)C

Isomeric SMILES

C/C(=C\1/C=C(C(=O)C2=C1C[C@H]3C[C@H]4[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]4(C(=O)C3=C2O)O)N(C)C)N)/NOC(C)(C)C

InChI

InChI=1S/C27H34N4O8/c1-10(30-39-26(2,3)4)12-9-15(28)20(32)17-13(12)7-11-8-14-19(31(5)6)22(34)18(25(29)37)24(36)27(14,38)23(35)16(11)21(17)33/h9,11,14,19,30,33,37-38H,7-8,28-29H2,1-6H3/b12-10+,25-18-/t11-,14-,19-,27-/m0/s1