cyclopenta-1,3-diene; prop-2-ynoic acid; titanium

Systemtic Name: cyclopenta-1,3-diene; prop-2-ynoic acid; titanium Openeye Name: cyclopenta-1,3-diene; prop-2-ynoic acid; titanium CAS Name: cyclopenta-1,3-diene; 2-propynoic acid; titanium IUPAC Name: cyclopenta-1,3-diene; prop-2-ynoic acid; titanium Traditional Name: cyclopenta-1,3-diene; propiolic acid; titanium Formula: C14H11O6Ti- MolecularWeight: 323.10054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC(=O)O.C#CC(=O)O.C#CC(=O)O.C1C=CC=[C-]1.[Ti]

Isomeric SMILES

C#CC(=O)O.C#CC(=O)O.C#CC(=O)O.C1C=CC=[C-]1.[Ti]

InChI

InChI=1S/C5H5.3C3H2O2.Ti/c1-2-4-5-3-1;3*1-2-3(4)5;/h1-3H,4H2;3*1H,(H,4,5);/q-1;;;;