propanoic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene

Systemtic Name: propanoic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene Openeye Name: propionic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene CAS Name: propanoic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene IUPAC Name: propanoic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene Traditional Name: propionic acid; titanium; 1,2,3-trimethylcyclopenta-1,3-diene Formula: C17H29O6Ti- MolecularWeight: 377.27556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11.3C3H6O2.Ti/c1-6-4-5-7(2)8(6)3;3*1-2-3(4)5;/h4H2,1-3H3;3*2H2,1H3,(H,4,5);/q-1;;;;