(2-chlorophenyl)methanediol; zinc; pentahydrate

Systemtic Name: (2-chlorophenyl)methanediol; zinc; pentahydrate Openeye Name: (2-chlorophenyl)methanediol; zinc; pentahydrate CAS Name: (2-chlorophenyl)methanediol; zinc; pentahydrate IUPAC Name: (2-chlorophenyl)methanediol; zinc; pentahydrate Traditional Name: (2-chlorophenyl)methanediol; zinc; pentahydrate Formula: C21H31Cl3O11Zn5 MolecularWeight: 892.86824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(O)O)Cl.C1=CC=C(C(=C1)C(O)O)Cl.C1=CC=C(C(=C1)C(O)O)Cl.O.O.O.O.O.[Zn].[Zn].[Zn].[Zn].[Zn]

Isomeric SMILES

C1=CC=C(C(=C1)C(O)O)Cl.C1=CC=C(C(=C1)C(O)O)Cl.C1=CC=C(C(=C1)C(O)O)Cl.O.O.O.O.O.[Zn].[Zn].[Zn].[Zn].[Zn]

InChI

InChI=1S/3C7H7ClO2.5H2O.5Zn/c3*8-6-4-2-1-3-5(6)7(9)10;;;;;;;;;;/h3*1-4,7,9-10H;5*1H2;;;;;