methanolate; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-9-ide; propanoic acid; titanium(3+)

Systemtic Name: methanolate; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-9-ide; propanoic acid; titanium(3+) Openeye Name: methanolate; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-9-ide; propionic acid; titanium(3+) CAS Name: methanolate; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-9-ide; propanoic acid; titanium(3+) IUPAC Name: methanolate; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-9-ide; propanoic acid; titanium(3+) Traditional Name: methanolate; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-9-ide; propionic acid; titanium(3+) Formula: C18H29O4Ti MolecularWeight: 357.28746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)O.C[O-].C[O-].C1CCC2=C(C1)[CH-]C3=C2CCCC3.[Ti+3]

Isomeric SMILES

CCC(=O)O.C[O-].C[O-].C1CCC2=C(C1)[CH-]C3=C2CCCC3.[Ti+3]

InChI

InChI=1S/C13H17.C3H6O2.2CH3O.Ti/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-2-3(4)5;2*1-2;/h9H,1-8H2;2H2,1H3,(H,4,5);2*1H3;/q-1;;2*-1;+3