4-methyl-2-(phenylmethyl)benzenesulfonate

Systemtic Name: 4-methyl-2-(phenylmethyl)benzenesulfonate Openeye Name: 2-benzyl-4-methyl-benzenesulfonate CAS Name: 4-methyl-2-(phenylmethyl)benzenesulfonate IUPAC Name: 2-benzyl-4-methylbenzenesulfonate Traditional Name: 2-benzyl-4-methyl-besylate Formula: C14H13O3S- MolecularWeight: 261.31622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C14H14O3S/c1-11-7-8-14(18(15,16)17)13(9-11)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,15,16,17)/p-1