1,2,3,4,5-pentakis(bromanyl)-6-(2-bromophenyl)benzene hydrate

Systemtic Name: 1,2,3,4,5-pentakis(bromanyl)-6-(2-bromophenyl)benzene hydrate Openeye Name: 1,2,3,4,5-pentabromo-6-(2-bromophenyl)benzene hydrate CAS Name: 1,2,3,4,5-pentabromo-6-(2-bromophenyl)benzene hydrate IUPAC Name: 1,2,3,4,5-pentabromo-6-(2-bromophenyl)benzene hydrate Traditional Name: 1,2,3,4,5-pentabromo-6-(2-bromophenyl)benzene hydrate Formula: C24H10Br12O MolecularWeight: 1273.1836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br.C1=CC=C(C(=C1)C2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br.O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br.C1=CC=C(C(=C1)C2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br.O

InChI

InChI=1S/2C12H4Br6.H2O/c2*13-6-4-2-1-3-5(6)7-8(14)10(16)12(18)11(17)9(7)15;/h2*1-4H;1H2