methyl 1-phenylethanesulfonate

Systemtic Name: methyl 1-phenylethanesulfonate Openeye Name: methyl 1-phenylethanesulfonate CAS Name: 1-phenylethanesulfonic acid methyl ester IUPAC Name: methyl 1-phenylethanesulfonate Traditional Name: 1-phenylethanesulfonic acid methyl ester Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)S(=O)(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)S(=O)(=O)OC

InChI

InChI=1S/C9H12O3S/c1-8(13(10,11)12-2)9-6-4-3-5-7-9/h3-8H,1-2H3