ethane-1,2-diol; 16-methylheptadecan-1-one; oxidanylidenetitanium

Systemtic Name: ethane-1,2-diol; 16-methylheptadecan-1-one; oxidanylidenetitanium Openeye Name: ethylene glycol; 16-methylheptadecan-1-one; oxotitanium CAS Name: ethane-1,2-diol; 16-methyl-1-heptadecanone; oxotitanium IUPAC Name: ethane-1,2-diol; 16-methylheptadecan-1-one; oxotitanium Traditional Name: ethylene glycol; ketotitanium; 16-methylheptadecan-1-one Formula: C38H76O5Ti-2 MolecularWeight: 660.87404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCC[C-]=O.CC(C)CCCCCCCCCCCCCC[C-]=O.C(CO)O.O=[Ti]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCC[C-]=O.CC(C)CCCCCCCCCCCCCC[C-]=O.C(CO)O.O=[Ti]

InChI

InChI=1S/2C18H35O.C2H6O2.O.Ti/c2*1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19;3-1-2-4;;/h2*18H,3-16H2,1-2H3;3-4H,1-2H2;;/q2*-1;;;