dibutyltin; [2-(4-nitrophenyl)phenyl]methanediol

Systemtic Name: dibutyltin; [2-(4-nitrophenyl)phenyl]methanediol Openeye Name: dibutyltin; [2-(4-nitrophenyl)phenyl]methanediol CAS Name: dibutyltin; [2-(4-nitrophenyl)phenyl]methanediol IUPAC Name: dibutyltin; [2-(4-nitrophenyl)phenyl]methanediol Traditional Name: dibutyltin; [2-(4-nitrophenyl)phenyl]methanediol Formula: C34H40N2O8Sn MolecularWeight: 723.4

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]CCCC.C1=CC=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C(O)O.C1=CC=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C(O)O

Isomeric SMILES

CCCC[Sn]CCCC.C1=CC=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C(O)O.C1=CC=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C(O)O

InChI

InChI=1S/2C13H11NO4.2C4H9.Sn/c2*15-13(16)12-4-2-1-3-11(12)9-5-7-10(8-6-9)14(17)18;2*1-3-4-2;/h2*1-8,13,15-16H;2*1,3-4H2,2H3;