[7-(4-methoxyphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [7-(4-methoxyphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid [7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 2-(4-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [2-keto-7-(4-methoxyphenyl)-1,3-benzoxathiol-5-yl] ester Formula: C23H17ClO6S MolecularWeight: 456.89548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC2=CC3=C(C(=C2)C4=CC=C(C=C4)OC)OC(=O)S3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OC2=CC3=C(C(=C2)C4=CC=C(C=C4)OC)OC(=O)S3)Cl

InChI

InChI=1S/C23H17ClO6S/c1-13-9-16(7-8-19(13)24)28-12-21(25)29-17-10-18(14-3-5-15(27-2)6-4-14)22-20(11-17)31-23(26)30-22/h3-11H,12H2,1-2H3