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

Systemtic Name: benzoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(3+) Openeye Name: benzoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(3+) CAS Name: benzoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(3+) IUPAC Name: benzoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(3+) Traditional Name: benzoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(3+) Formula: C22H29O2Ti MolecularWeight: 373.33146

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].C1CCC2=C(C1)CC3=C2CCC[CH-]3.C1=CC=C(C=C1)C(=O)O.[Ti+3]

Isomeric SMILES

[CH3-].[CH3-].C1CCC2=C(C1)CC3=C2CCC[CH-]3.C1=CC=C(C=C1)C(=O)O.[Ti+3]

InChI

InChI=1S/C13H17.C7H6O2.2CH3.Ti/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;8-7(9)6-4-2-1-3-5-6;;;/h5H,1-4,6-9H2;1-5H,(H,8,9);2*1H3;/q-1;;2*-1;+3