tert-butyl N-[(9Z)-9-[azanyl(oxidanyl)methylidene]-4,7-bis(dimethylamino)-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate

Systemtic Name: tert-butyl N-[(9Z)-9-[azanyl(oxidanyl)methylidene]-4,7-bis(dimethylamino)-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate Openeye Name: tert-butyl N-[(9Z)-9-[amino(hydroxy)methylene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate CAS Name: N-[(9Z)-9-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(9Z)-9-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate Traditional Name: N-[(9Z)-9-[amino(hydroxy)methylene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-triketo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamic acid tert-butyl ester Formula: C28H36N4O9 MolecularWeight: 572.60684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C2=C(CC3CC4C(C(=O)C(=C(N)O)C(=O)C4(C(=O)C3=C2O)O)N(C)C)C(=C1)N(C)C)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C2=C(CC3CC4C(C(=O)/C(=C(\N)/O)/C(=O)C4(C(=O)C3=C2O)O)N(C)C)C(=C1)N(C)C)O

InChI

InChI=1S/C28H36N4O9/c1-27(2,3)41-26(39)30-14-10-15(31(4)5)12-8-11-9-13-19(32(6)7)22(35)18(25(29)38)24(37)28(13,40)23(36)16(11)21(34)17(12)20(14)33/h10-11,13,19,33-34,38,40H,8-9,29H2,1-7H3,(H,30,39)/b25-18-