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zinc 4-methylbenzenesulfonate hydrate

zinc 4-methylbenzenesulfonate hydrate

Systemtic Name:zinc 4-methylbenzenesulfonate hydrate
Openeye Name:zinc 4-methylbenzenesulfonate hydrate
CAS Name:zinc 4-methylbenzenesulfonate hydrate
IUPAC Name:zinc 4-methylbenzenesulfonate hydrate
Traditional Name:zinc tosylate hydrate
Formula: C7H9O4SZn+
MolecularWeight: 254.61796
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].O.[Zn+2]


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].O.[Zn+2]


InChI

InChI=1S/C7H8O3S.H2O.Zn/c1-6-2-4-7(5-3-6)11(8,9)10;;/h2-5H,1H3,(H,8,9,10);1H2;/q;;+2/p-1


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