ethanolate; 8-oxidanidylquinoline-5-sulfonate; titanium(4+)

Systemtic Name: ethanolate; 8-oxidanidylquinoline-5-sulfonate; titanium(4+) Openeye Name: ethanolate; 8-oxidoquinoline-5-sulfonate; titanium(4+) CAS Name: ethanolate; 8-oxido-5-quinolinesulfonate; titanium(4+) IUPAC Name: ethanolate; 8-oxidoquinoline-5-sulfonate; titanium(4+) Traditional Name: ethanolate; 8-oxidoquinoline-5-sulfonate; titanium(4+) Formula: C22H20N2O10S2Ti-2 MolecularWeight: 584.3986

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)[O-].[Ti+4]

Isomeric SMILES

CC[O-].CC[O-].C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)[O-].[Ti+4]

InChI

InChI=1S/2C9H7NO4S.2C2H5O.Ti/c2*11-7-3-4-8(15(12,13)14)6-2-1-5-10-9(6)7;2*1-2-3;/h2*1-5,11H,(H,12,13,14);2*2H2,1H3;/q;;2*-1;+4/p-4