tris[1,2,6,7-tetrakis(bromanyl)-4-[[4,5,6,7-tetrakis(bromanyl)-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]heptan-4-yl] phosphate

Systemtic Name: tris[1,2,6,7-tetrakis(bromanyl)-4-[[4,5,6,7-tetrakis(bromanyl)-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]heptan-4-yl] phosphate Openeye Name: tris[3,4-dibromo-1-(2,3-dibromopropyl)-1-[(4,5,6,7-tetrabromo-1,3-dioxo-isoindolin-2-yl)methyl]butyl] phosphate CAS Name: phosphoric acid tris[1,2,6,7-tetrabromo-4-[(4,5,6,7-tetrabromo-1,3-dioxo-2-isoindolyl)methyl]heptan-4-yl] ester IUPAC Name: tris[1,2,6,7-tetrabromo-4-[(4,5,6,7-tetrabromo-1,3-dioxoisoindol-2-yl)methyl]heptan-4-yl] phosphate Traditional Name: phosphoric acid tris[3,4-dibromo-1-(2,3-dibromopropyl)-1-[(4,5,6,7-tetrabromo-1,3-diketo-isoindolin-2-yl)methyl]butyl] ester Formula: C48H36Br24N3O10P MolecularWeight: 2763.483301

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CBr)Br)C(CC(CBr)Br)(CN1C(=O)C2=C(C1=O)C(=C(C(=C2Br)Br)Br)Br)OP(=O)(OC(CC(CBr)Br)(CC(CBr)Br)CN3C(=O)C4=C(C3=O)C(=C(C(=C4Br)Br)Br)Br)OC(CC(CBr)Br)(CC(CBr)Br)CN5C(=O)C6=C(C5=O)C(=C(C(=C6Br)Br)Br)Br

Isomeric SMILES

C(C(CBr)Br)C(CC(CBr)Br)(CN1C(=O)C2=C(C1=O)C(=C(C(=C2Br)Br)Br)Br)OP(=O)(OC(CC(CBr)Br)(CC(CBr)Br)CN3C(=O)C4=C(C3=O)C(=C(C(=C4Br)Br)Br)Br)OC(CC(CBr)Br)(CC(CBr)Br)CN5C(=O)C6=C(C5=O)C(=C(C(=C6Br)Br)Br)Br

InChI

InChI=1S/C48H36Br24N3O10P/c49-7-16(55)1-46(2-17(56)8-50,13-73-40(76)22-23(41(73)77)29(62)35(68)34(67)28(22)61)83-86(82,84-47(3-18(57)9-51,4-19(58)10-52)14-74-42(78)24-25(43(74)79)31(64)37(70)36(69)30(24)63)85-48(5-20(59)11-53,6-21(60)12-54)15-75-44(80)26-27(45(75)81)33(66)39(72)38(71)32(26)65/h16-21H,1-15H2