benzoic acid; 1,9-dihydrofluoren-1-ide; titanium

Systemtic Name: benzoic acid; 1,9-dihydrofluoren-1-ide; titanium Openeye Name: benzoic acid; 1,9-dihydrofluoren-1-ide; titanium CAS Name: benzoic acid; 1,9-dihydrofluoren-1-ide; titanium IUPAC Name: benzoic acid; 1,9-dihydrofluoren-1-ide; titanium Traditional Name: benzoic acid; 1,9-dihydrofluoren-1-ide; titanium Formula: C34H27O6Ti- MolecularWeight: 579.44158

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)C(=O)O.[Ti]

Isomeric SMILES

C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)C(=O)O.[Ti]

InChI

InChI=1S/C13H9.3C7H6O2.Ti/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;3*8-7(9)6-4-2-1-3-5-6;/h1-5,7-8H,9H2;3*1-5H,(H,8,9);/q-1;;;;