benzene; carbanide; dipropan-2-yl hydrogen phosphite; oxidanylidenetitanium; dihydrate

Systemtic Name: benzene; carbanide; dipropan-2-yl hydrogen phosphite; oxidanylidenetitanium; dihydrate Openeye Name: benzene; carbanide; diisopropyl hydrogen phosphite; oxotitanium; dihydrate CAS Name: benzene; carbanide; dipropan-2-yl hydrogen phosphite; oxotitanium; dihydrate IUPAC Name: benzene; carbanide; dipropan-2-yl hydrogen phosphite; oxotitanium; dihydrate Traditional Name: benzene; carbanide; diisopropyl hydrogen phosphite; ketotitanium; dihydrate Formula: C26H50O9P2Ti-4 MolecularWeight: 616.484322

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CC(C)OP(O)OC(C)C.CC(C)OP(O)OC(C)C.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.O.O.O=[Ti]

Isomeric SMILES

[CH3-].[CH3-].CC(C)OP(O)OC(C)C.CC(C)OP(O)OC(C)C.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.O.O.O=[Ti]

InChI

InChI=1S/2C6H15O3P.2C6H5.2CH3.2H2O.O.Ti/c2*1-5(2)8-10(7)9-6(3)4;2*1-2-4-6-5-3-1;;;;;;/h2*5-7H,1-4H3;2*1-5H;2*1H3;2*1H2;;/q;;4*-1;;;;