(5-chloranyl-2-methoxy-phenyl)methyl 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid (5-chloro-2-methoxy-benzyl) ester Formula: C18H19ClO5S MolecularWeight: 382.85846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H19ClO5S/c1-13-3-6-16(7-4-13)25(21,22)10-9-18(20)24-12-14-11-15(19)5-8-17(14)23-2/h3-8,11H,9-10,12H2,1-2H3