ethanoic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene

Systemtic Name: ethanoic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene Openeye Name: acetic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene CAS Name: acetic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene IUPAC Name: acetic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene Traditional Name: acetic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene Formula: C14H23O6Ti- MolecularWeight: 335.19582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[C-]C1)C)C.CC(=O)O.CC(=O)O.CC(=O)O.[Ti]

Isomeric SMILES

CC1=C(C(=[C-]C1)C)C.CC(=O)O.CC(=O)O.CC(=O)O.[Ti]

InChI

InChI=1S/C8H11.3C2H4O2.Ti/c1-6-4-5-7(2)8(6)3;3*1-2(3)4;/h4H2,1-3H3;3*1H3,(H,3,4);/q-1;;;;