butan-1-ol; 2-butoxycarbonylbenzoic acid; titanium

Systemtic Name: butan-1-ol; 2-butoxycarbonylbenzoic acid; titanium Openeye Name: butan-1-ol; 2-butoxycarbonylbenzoic acid; titanium CAS Name: 1-butanol; 2-[butoxy(oxo)methyl]benzoic acid; titanium IUPAC Name: butan-1-ol; 2-butoxycarbonylbenzoic acid; titanium Traditional Name: butan-1-ol; 2-butoxycarbonylbenzoic acid; titanium Formula: C24H44O7Ti MolecularWeight: 492.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.CCCCO.CCCCOC(=O)C1=CC=CC=C1C(=O)O.[Ti]

Isomeric SMILES

CCCCO.CCCCO.CCCCO.CCCCOC(=O)C1=CC=CC=C1C(=O)O.[Ti]

InChI

InChI=1S/C12H14O4.3C4H10O.Ti/c1-2-3-8-16-12(15)10-7-5-4-6-9(10)11(13)14;3*1-2-3-4-5;/h4-7H,2-3,8H2,1H3,(H,13,14);3*5H,2-4H2,1H3;