butan-1-ol; 11,20-dioxaspiro[8.11]icosan-10-one; titanium

Systemtic Name: butan-1-ol; 11,20-dioxaspiro[8.11]icosan-10-one; titanium Openeye Name: butan-1-ol; 11,20-dioxaspiro[8.11]icosan-10-one; titanium CAS Name: 1-butanol; 11,20-dioxaspiro[8.11]eicosan-10-one; titanium IUPAC Name: butan-1-ol; 11,20-dioxaspiro[8.11]icosan-10-one; titanium Traditional Name: butan-1-ol; 11,20-dioxaspiro[8.11]eicosan-10-one; titanium Formula: C22H42O4Ti MolecularWeight: 418.43348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.C1CCCCC2(CCC1)C(=O)OCCCCCCCCO2.[Ti]

Isomeric SMILES

CCCCO.C1CCCCC2(CCC1)C(=O)OCCCCCCCCO2.[Ti]

InChI

InChI=1S/C18H32O3.C4H10O.Ti/c19-17-18(13-9-5-1-2-6-10-14-18)21-16-12-8-4-3-7-11-15-20-17;1-2-3-4-5;/h1-16H2;5H,2-4H2,1H3;