cycloheptylmethanol; 4-methylbenzenesulfonate

Systemtic Name: cycloheptylmethanol; 4-methylbenzenesulfonate Openeye Name: cycloheptylmethanol; 4-methylbenzenesulfonate CAS Name: cycloheptylmethanol; 4-methylbenzenesulfonate IUPAC Name: cycloheptylmethanol; 4-methylbenzenesulfonate Traditional Name: cycloheptylmethanol tosylate Formula: C15H23O4S- MolecularWeight: 299.40572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CCCC(CC1)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CCCC(CC1)CO

InChI

InChI=1S/C8H16O.C7H8O3S/c9-7-8-5-3-1-2-4-6-8;1-6-2-4-7(5-3-6)11(8,9)10/h8-9H,1-7H2;2-5H,1H3,(H,8,9,10)/p-1