[3-methyl-4-(trioxidanylsulfanyl)phenyl] 3-chloranylpropanoate

Systemtic Name: [3-methyl-4-(trioxidanylsulfanyl)phenyl] 3-chloranylpropanoate Openeye Name: [3-methyl-4-(trioxidanylsulfanyl)phenyl] 3-chloropropanoate CAS Name: 3-chloropropanoic acid [3-methyl-4-(trioxidanylthio)phenyl] ester IUPAC Name: [3-methyl-4-(trioxidanylsulfanyl)phenyl] 3-chloropropanoate Traditional Name: 3-chloropropionic acid [3-methyl-4-(trioxidanylthio)phenyl] ester Formula: C10H11ClO5S MolecularWeight: 278.70934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)CCCl)SOOO

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)CCCl)SOOO

InChI

InChI=1S/C10H11ClO5S/c1-7-6-8(14-10(12)4-5-11)2-3-9(7)17-16-15-13/h2-3,6,13H,4-5H2,1H3