dibutyltin(2+); phenoxy(phosphonatomethyl)phosphinate

Systemtic Name: dibutyltin(2+); phenoxy(phosphonatomethyl)phosphinate Openeye Name: dibutyltin(2+); phenoxy(phosphonatomethyl)phosphinate CAS Name: dibutyltin(2+); phenoxy(phosphonatomethyl)phosphinate IUPAC Name: dibutyltin(2+); phenoxy(phosphonatomethyl)phosphinate Traditional Name: dibutyltin(2+); phenoxy(phosphonatomethyl)phosphinate Formula: C38H68O12P4Sn3 MolecularWeight: 1196.964364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.C1=CC=C(C=C1)OP(=O)(CP(=O)([O-])[O-])[O-].C1=CC=C(C=C1)OP(=O)(CP(=O)([O-])[O-])[O-]

Isomeric SMILES

CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.C1=CC=C(C=C1)OP(=O)(CP(=O)([O-])[O-])[O-].C1=CC=C(C=C1)OP(=O)(CP(=O)([O-])[O-])[O-]

InChI

InChI=1S/2C7H10O6P2.6C4H9.3Sn/c2*8-14(9,10)6-15(11,12)13-7-4-2-1-3-5-7;6*1-3-4-2;;;/h2*1-5H,6H2,(H,11,12)(H2,8,9,10);6*1,3-4H2,2H3;;;/q;;;;;;;;3*+2/p-6