[4-(1,3-dithiolan-2-yl)phenyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-(4-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C18H17ClO3S2 MolecularWeight: 380.90878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClO3S2/c1-12-10-15(6-7-16(12)19)21-11-17(20)22-14-4-2-13(3-5-14)18-23-8-9-24-18/h2-7,10,18H,8-9,11H2,1H3