2-methylheptadecane; oxidanylidenetitanium; propan-2-ol

Systemtic Name: 2-methylheptadecane; oxidanylidenetitanium; propan-2-ol Openeye Name: 2-methylheptadecane; oxotitanium; propan-2-ol CAS Name: 2-methylheptadecane; oxotitanium; 2-propanol IUPAC Name: 2-methylheptadecane; oxotitanium; propan-2-ol Traditional Name: ketotitanium; 2-methylheptadecane; propan-2-ol Formula: C42H90O3Ti-2 MolecularWeight: 691.0292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCC[CH2-].CC(C)CCCCCCCCCCCCCC[CH2-].CC(C)O.CC(C)O.O=[Ti]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCC[CH2-].CC(C)CCCCCCCCCCCCCC[CH2-].CC(C)O.CC(C)O.O=[Ti]

InChI

InChI=1S/2C18H37.2C3H8O.O.Ti/c2*1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)3;2*1-3(2)4;;/h2*18H,1,4-17H2,2-3H3;2*3-4H,1-2H3;;/q2*-1;;;;