prop-2-ynoic acid; titanium; 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide

Systemtic Name: prop-2-ynoic acid; titanium; 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide Openeye Name: prop-2-ynoic acid; titanium; 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide CAS Name: 2-propynoic acid; titanium; 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide IUPAC Name: prop-2-ynoic acid; titanium; 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide Traditional Name: propiolic acid; titanium; 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide Formula: C21H23O6Ti- MolecularWeight: 419.27072

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C(=C(C2=C1CCCC2)C)C.C#CC(=O)O.C#CC(=O)O.C#CC(=O)O.[Ti]

Isomeric SMILES

C[C-]1C(=C(C2=C1CCCC2)C)C.C#CC(=O)O.C#CC(=O)O.C#CC(=O)O.[Ti]

InChI

InChI=1S/C12H17.3C3H2O2.Ti/c1-8-9(2)11-6-4-5-7-12(11)10(8)3;3*1-2-3(4)5;/h4-7H2,1-3H3;3*1H,(H,4,5);/q-1;;;;