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

Systemtic Name: 2,3-dimethylcyclopenta-1,3-diene; ethanoic acid; titanium Openeye Name: acetic acid; 2,3-dimethylcyclopenta-1,3-diene; titanium CAS Name: acetic acid; 2,3-dimethylcyclopenta-1,3-diene; titanium IUPAC Name: acetic acid; 2,3-dimethylcyclopenta-1,3-diene; titanium Traditional Name: acetic acid; 2,3-dimethylcyclopenta-1,3-diene; titanium Formula: C13H21O6Ti- MolecularWeight: 321.16924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9.3C2H4O2.Ti/c1-6-4-3-5-7(6)2;3*1-2(3)4;/h4H,3H2,1-2H3;3*1H3,(H,3,4);/q-1;;;;