1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; propanoic acid; titanium

Systemtic Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; propanoic acid; titanium Openeye Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; propionic acid; titanium CAS Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; propanoic acid; titanium IUPAC Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; propanoic acid; titanium Traditional Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; propionic acid; titanium Formula: C20H33O6Ti- MolecularWeight: 417.33942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)O.CCC(=O)O.CCC(=O)O.C[C-]1C(=CC2=C1CCCC2)C.[Ti]

Isomeric SMILES

CCC(=O)O.CCC(=O)O.CCC(=O)O.C[C-]1C(=CC2=C1CCCC2)C.[Ti]

InChI

InChI=1S/C11H15.3C3H6O2.Ti/c1-8-7-10-5-3-4-6-11(10)9(8)2;3*1-2-3(4)5;/h7H,3-6H2,1-2H3;3*2H2,1H3,(H,4,5);/q-1;;;;