(2-methoxy-5-methyl-phenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C19H20O3S2 MolecularWeight: 360.4903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O3S2/c1-13-3-8-17(21-2)16(11-13)12-22-18(20)14-4-6-15(7-5-14)19-23-9-10-24-19/h3-8,11,19H,9-10,12H2,1-2H3