2-phenylethanoate; titanium(2+)

Systemtic Name: 2-phenylethanoate; titanium(2+) Openeye Name: 2-phenylacetate; titanium(2+) CAS Name: 2-phenylacetate; titanium(2+) IUPAC Name: 2-phenylacetate; titanium(2+) Traditional Name: 2-phenylacetate; titanium(2+) Formula: C32H28O8Ti2 MolecularWeight: 636.29392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)[O-].C1=CC=C(C=C1)CC(=O)[O-].C1=CC=C(C=C1)CC(=O)[O-].C1=CC=C(C=C1)CC(=O)[O-].[Ti+2].[Ti+2]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)[O-].C1=CC=C(C=C1)CC(=O)[O-].C1=CC=C(C=C1)CC(=O)[O-].C1=CC=C(C=C1)CC(=O)[O-].[Ti+2].[Ti+2]

InChI

InChI=1S/4C8H8O2.2Ti/c4*9-8(10)6-7-4-2-1-3-5-7;;/h4*1-5H,6H2,(H,9,10);;/q;;;;2*+2/p-4