4-methylbenzenesulfonate; 2-phenoxyethanol

Systemtic Name: 4-methylbenzenesulfonate; 2-phenoxyethanol Openeye Name: 4-methylbenzenesulfonate; 2-phenoxyethanol CAS Name: 4-methylbenzenesulfonate; 2-phenoxyethanol IUPAC Name: 4-methylbenzenesulfonate; 2-phenoxyethanol Traditional Name: 2-phenoxyethanol tosylate Formula: C15H17O5S- MolecularWeight: 309.35748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10O2.C7H8O3S/c9-6-7-10-8-4-2-1-3-5-8;1-6-2-4-7(5-3-6)11(8,9)10/h1-5,9H,6-7H2;2-5H,1H3,(H,8,9,10)/p-1