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

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 3,5-dimethylbenzoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C19H20O3S2 MolecularWeight: 360.4903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O3S2/c1-12-8-13(2)10-15(9-12)18(20)22-16-5-4-14(11-17(16)21-3)19-23-6-7-24-19/h4-5,8-11,19H,6-7H2,1-3H3