methanol; 4-methylbenzenesulfonic acid

Systemtic Name: methanol; 4-methylbenzenesulfonic acid Openeye Name: methanol; 4-methylbenzenesulfonic acid CAS Name: methanol; 4-methylbenzenesulfonic acid IUPAC Name: methanol; 4-methylbenzenesulfonic acid Traditional Name: methanol; tosylic acid Formula: C16H24O8S2 MolecularWeight: 408.48696

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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.CO.CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.CO.CO

InChI

InChI=1S/2C7H8O3S.2CH4O/c2*1-6-2-4-7(5-3-6)11(8,9)10;2*1-2/h2*2-5H,1H3,(H,8,9,10);2*2H,1H3