(2S,4aR,12aR)-9,12-bis(bromanyl)-2,6,7,10,11-pentamethoxy-2-methyl-1,3,4,4a,12,12a-hexahydrotetracen-5-one

Systemtic Name: (2S,4aR,12aR)-9,12-bis(bromanyl)-2,6,7,10,11-pentamethoxy-2-methyl-1,3,4,4a,12,12a-hexahydrotetracen-5-one Openeye Name: (2S,4aR,12aR)-9,12-dibromo-2,6,7,10,11-pentamethoxy-2-methyl-1,3,4,4a,12,12a-hexahydrotetracen-5-one CAS Name: (2S,4aR,12aR)-9,12-dibromo-2,6,7,10,11-pentamethoxy-2-methyl-1,3,4,4a,12,12a-hexahydrotetracen-5-one IUPAC Name: (2S,4aR,12aR)-9,12-dibromo-2,6,7,10,11-pentamethoxy-2-methyl-1,3,4,4a,12,12a-hexahydrotetracen-5-one Traditional Name: (2S,4aR,12aR)-9,12-dibromo-2,6,7,10,11-pentamethoxy-2-methyl-1,3,4,4a,12,12a-hexahydrotetracen-5-one Formula: C24H28Br2O6 MolecularWeight: 572.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2C(C1)C(C3=C(C4=C(C(=CC(=C4OC)Br)OC)C(=C3C2=O)OC)OC)Br)OC

Isomeric SMILES

C[C@@]1(CC[C@@H]2[C@@H](C1)C(C3=C(C4=C(C(=CC(=C4OC)Br)OC)C(=C3C2=O)OC)OC)Br)OC

InChI

InChI=1S/C24H28Br2O6/c1-24(32-6)8-7-11-12(10-24)19(26)16-17(20(11)27)22(30-4)15-14(28-2)9-13(25)21(29-3)18(15)23(16)31-5/h9,11-12,19H,7-8,10H2,1-6H3/t11-,12-,19?,24+/m1/s1