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

Systemtic Name: (4-chlorophenyl) N-[(7S,9Z,10aS)-9-[azanyl(oxidanyl)methylidene]-5,7-bis(dimethylamino)-1,10a,12-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate Openeye Name: (4-chlorophenyl) N-[(7S,9Z,10aS)-9-[amino(hydroxy)methylene]-5,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate CAS Name: N-[(7S,9Z,10aS)-9-[amino(hydroxy)methylidene]-5,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) N-[(7S,9Z,10aS)-9-[amino(hydroxy)methylidene]-5,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamate Traditional Name: N-[(7S,9Z,10aS)-9-[amino(hydroxy)methylene]-5,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-triketo-5a,6,6a,7-tetrahydro-5H-tetracen-2-yl]carbamic acid (4-chlorophenyl) ester Formula: C30H31ClN4O9 MolecularWeight: 627.04154

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C2CC3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC(=C4O)NC(=O)OC5=CC=C(C=C5)Cl)O)O)N(C)C

Isomeric SMILES

CN(C)[C@H]1C2CC3C(C4=C(C(=C(C=C4)NC(=O)OC5=CC=C(C=C5)Cl)O)C(=C3C(=O)[C@@]2(C(=O)/C(=C(/N)\O)/C1=O)O)O)N(C)C

InChI

InChI=1S/C30H31ClN4O9/c1-34(2)21-14-9-10-17(33-29(42)44-13-7-5-12(31)6-8-13)23(36)18(14)24(37)19-15(21)11-16-22(35(3)4)25(38)20(28(32)41)27(40)30(16,43)26(19)39/h5-10,15-16,21-22,36-37,41,43H,11,32H2,1-4H3,(H,33,42)/b28-20-/t15?,16?,21?,22-,30-/m0/s1