butanoic acid; 1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium

Systemtic Name: butanoic acid; 1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium Openeye Name: butyric acid; 1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium CAS Name: butanoic acid; 1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium IUPAC Name: butanoic acid; 1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium Traditional Name: butyric acid; 1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium Formula: C21H37O6Ti- MolecularWeight: 433.38188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)O.CCCC(=O)O.CCCC(=O)O.CC1[C-]=C(C(=C1C)C)C.[Ti]

Isomeric SMILES

CCCC(=O)O.CCCC(=O)O.CCCC(=O)O.CC1[C-]=C(C(=C1C)C)C.[Ti]

InChI

InChI=1S/C9H13.3C4H8O2.Ti/c1-6-5-7(2)9(4)8(6)3;3*1-2-3-4(5)6;/h6H,1-4H3;3*2-3H2,1H3,(H,5,6);/q-1;;;;