ethane-1,2-diol; 16-methylheptadecanoic acid; titanium

Systemtic Name: ethane-1,2-diol; 16-methylheptadecanoic acid; titanium Openeye Name: ethylene glycol; 16-methylheptadecanoic acid; titanium CAS Name: ethane-1,2-diol; 16-methylheptadecanoic acid; titanium IUPAC Name: ethane-1,2-diol; 16-methylheptadecanoic acid; titanium Traditional Name: ethylene glycol; 16-methylheptadecanoic acid; titanium Formula: C38H78O6Ti MolecularWeight: 678.88932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.C(CO)O.[Ti]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.C(CO)O.[Ti]

InChI

InChI=1S/2C18H36O2.C2H6O2.Ti/c2*1-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20;3-1-2-4;/h2*17H,3-16H2,1-2H3,(H,19,20);3-4H,1-2H2;