phenacyl 3-(4-methoxyphenyl)sulfonylpropanoate

Systemtic Name: phenacyl 3-(4-methoxyphenyl)sulfonylpropanoate Openeye Name: phenacyl 3-(4-methoxyphenyl)sulfonylpropanoate CAS Name: 3-(4-methoxyphenyl)sulfonylpropanoic acid phenacyl ester IUPAC Name: phenacyl 3-(4-methoxyphenyl)sulfonylpropanoate Traditional Name: 3-(4-methoxyphenyl)sulfonylpropionic acid phenacyl ester Formula: C18H18O6S MolecularWeight: 362.39692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18O6S/c1-23-15-7-9-16(10-8-15)25(21,22)12-11-18(20)24-13-17(19)14-5-3-2-4-6-14/h2-10H,11-13H2,1H3