4-methylbenzenesulfonic acid carbonate hydrate

Systemtic Name: 4-methylbenzenesulfonic acid carbonate hydrate Openeye Name: 4-methylbenzenesulfonic acid carbonate hydrate CAS Name: 4-methylbenzenesulfonic acid carbonate hydrate IUPAC Name: 4-methylbenzenesulfonic acid carbonate hydrate Traditional Name: tosylic acid carbonate hydrate Formula: C15H18O10S2-2 MolecularWeight: 422.42742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H8O3S.CH2O3.H2O/c2*1-6-2-4-7(5-3-6)11(8,9)10;2-1(3)4;/h2*2-5H,1H3,(H,8,9,10);(H2,2,3,4);1H2/p-2