4-methylbenzenesulfonate; 11-phenylundecan-1-ol

Systemtic Name: 4-methylbenzenesulfonate; 11-phenylundecan-1-ol Openeye Name: 4-methylbenzenesulfonate; 11-phenylundecan-1-ol CAS Name: 4-methylbenzenesulfonate; 11-phenyl-1-undecanol IUPAC Name: 4-methylbenzenesulfonate; 11-phenylundecan-1-ol Traditional Name: 11-phenylundecan-1-ol tosylate Formula: C24H35O4S- MolecularWeight: 419.5973

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28O.C7H8O3S/c18-16-12-7-5-3-1-2-4-6-9-13-17-14-10-8-11-15-17;1-6-2-4-7(5-3-6)11(8,9)10/h8,10-11,14-15,18H,1-7,9,12-13,16H2;2-5H,1H3,(H,8,9,10)/p-1