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

Systemtic Name: ethanoic acid; 2-methylcyclopenta-1,3-diene; titanium Openeye Name: acetic acid; 2-methylcyclopenta-1,3-diene; titanium CAS Name: acetic acid; 2-methylcyclopenta-1,3-diene; titanium IUPAC Name: acetic acid; 2-methylcyclopenta-1,3-diene; titanium Traditional Name: acetic acid; 2-methylcyclopenta-1,3-diene; titanium Formula: C12H19O6Ti- MolecularWeight: 307.14266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7.3C2H4O2.Ti/c1-6-4-2-3-5-6;3*1-2(3)4;/h2,4H,3H2,1H3;3*1H3,(H,3,4);/q-1;;;;