[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(2,5-dimethylphenoxy)ethanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(2,5-dimethylphenoxy)ethanoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(2,5-dimethylphenoxy)acetate CAS Name: 2-(2,5-dimethylphenoxy)acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 2-(2,5-dimethylphenoxy)acetate Traditional Name: 2-(2,5-dimethylphenoxy)acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C20H22O4S2 MolecularWeight: 390.51628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)OC2=C(C=C(C=C2)C3SCCS3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)OC2=C(C=C(C=C2)C3SCCS3)OC

InChI

InChI=1S/C20H22O4S2/c1-13-4-5-14(2)17(10-13)23-12-19(21)24-16-7-6-15(11-18(16)22-3)20-25-8-9-26-20/h4-7,10-11,20H,8-9,12H2,1-3H3