ethane-1,2-diol; [octoxy(oxidanidyl)phosphoryl] octyl phosphate; oxidanylidenetitanium

Systemtic Name: ethane-1,2-diol; [octoxy(oxidanidyl)phosphoryl] octyl phosphate; oxidanylidenetitanium Openeye Name: ethylene glycol; [octoxy(oxido)phosphoryl] octyl phosphate; oxotitanium CAS Name: ethane-1,2-diol; [octoxy(oxido)phosphoryl] octyl phosphate; oxotitanium IUPAC Name: ethane-1,2-diol; [octoxy(oxido)phosphoryl] octyl phosphate; oxotitanium Traditional Name: ethylene glycol; ketotitanium; [octoxy(oxido)phosphoryl] octyl phosphate Formula: C34H74O17P4Ti-4 MolecularWeight: 926.703204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)([O-])OP(=O)([O-])OCCCCCCCC.CCCCCCCCOP(=O)([O-])OP(=O)([O-])OCCCCCCCC.C(CO)O.O=[Ti]

Isomeric SMILES

CCCCCCCCOP(=O)([O-])OP(=O)([O-])OCCCCCCCC.CCCCCCCCOP(=O)([O-])OP(=O)([O-])OCCCCCCCC.C(CO)O.O=[Ti]

InChI

InChI=1S/2C16H36O7P2.C2H6O2.O.Ti/c2*1-3-5-7-9-11-13-15-21-24(17,18)23-25(19,20)22-16-14-12-10-8-6-4-2;3-1-2-4;;/h2*3-16H2,1-2H3,(H,17,18)(H,19,20);3-4H,1-2H2;;/p-4