(1-butylsulfonyl-3-phenoxy-propan-2-yl) benzoate

Systemtic Name: (1-butylsulfonyl-3-phenoxy-propan-2-yl) benzoate Openeye Name: [1-(butylsulfonylmethyl)-2-phenoxy-ethyl] benzoate CAS Name: benzoic acid (1-butylsulfonyl-3-phenoxypropan-2-yl) ester IUPAC Name: (1-butylsulfonyl-3-phenoxypropan-2-yl) benzoate Traditional Name: benzoic acid [1-(butylsulfonylmethyl)-2-phenoxy-ethyl] ester Formula: C20H24O5S MolecularWeight: 376.46656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CC(COC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCS(=O)(=O)CC(COC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H24O5S/c1-2-3-14-26(22,23)16-19(15-24-18-12-8-5-9-13-18)25-20(21)17-10-6-4-7-11-17/h4-13,19H,2-3,14-16H2,1H3