(2-oxidanylidene-7-phenyl-1,3-benzoxathiol-5-yl) 2-(3,4-dimethylphenoxy)ethanoate

Systemtic Name: (2-oxidanylidene-7-phenyl-1,3-benzoxathiol-5-yl) 2-(3,4-dimethylphenoxy)ethanoate Openeye Name: (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) 2-(3,4-dimethylphenoxy)acetate CAS Name: 2-(3,4-dimethylphenoxy)acetic acid (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) ester IUPAC Name: (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) 2-(3,4-dimethylphenoxy)acetate Traditional Name: 2-(3,4-dimethylphenoxy)acetic acid (2-keto-7-phenyl-1,3-benzoxathiol-5-yl) ester Formula: C23H18O5S MolecularWeight: 406.45102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18O5S/c1-14-8-9-17(10-15(14)2)26-13-21(24)27-18-11-19(16-6-4-3-5-7-16)22-20(12-18)29-23(25)28-22/h3-12H,13H2,1-2H3