2,3-di(nonyl)phenol; propan-2-ol; titanium; hydroxide

Systemtic Name: 2,3-di(nonyl)phenol; propan-2-ol; titanium; hydroxide Openeye Name: 2,3-di(nonyl)phenol; propan-2-ol; titanium; hydroxide CAS Name: 2,3-di(nonyl)phenol; 2-propanol; titanium; hydroxide IUPAC Name: 2,3-di(nonyl)phenol; propan-2-ol; titanium; hydroxide Traditional Name: 2,3-di(nonyl)phenol; propan-2-ol; titanium; hydroxide Formula: C30H59O4Ti- MolecularWeight: 531.65406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCCC.CC(C)O.CC(C)O.[OH-].[Ti]

Isomeric SMILES

CCCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCCC.CC(C)O.CC(C)O.[OH-].[Ti]

InChI

InChI=1S/C24H42O.2C3H8O.H2O.Ti/c1-3-5-7-9-11-13-15-18-22-19-17-21-24(25)23(22)20-16-14-12-10-8-6-4-2;2*1-3(2)4;;/h17,19,21,25H,3-16,18,20H2,1-2H3;2*3-4H,1-2H3;1H2;/p-1