butan-1-ol; methyl 3-oxidanylidenebutanoate; titanium

Systemtic Name: butan-1-ol; methyl 3-oxidanylidenebutanoate; titanium Openeye Name: butan-1-ol; methyl 3-oxobutanoate; titanium CAS Name: 1-butanol; 3-oxobutanoic acid methyl ester; titanium IUPAC Name: butan-1-ol; methyl 3-oxobutanoate; titanium Traditional Name: butan-1-ol; 3-ketobutyric acid methyl ester; titanium Formula: C18H36O8Ti MolecularWeight: 428.34064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.CC(=O)CC(=O)OC.CC(=O)CC(=O)OC.[Ti]

Isomeric SMILES

CCCCO.CCCCO.CC(=O)CC(=O)OC.CC(=O)CC(=O)OC.[Ti]

InChI

InChI=1S/2C5H8O3.2C4H10O.Ti/c2*1-4(6)3-5(7)8-2;2*1-2-3-4-5;/h2*3H2,1-2H3;2*5H,2-4H2,1H3;