methyl 3-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]sulfonyl-4-methyl-benzoate

Systemtic Name: methyl 3-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]sulfonyl-4-methyl-benzoate Openeye Name: methyl 3-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]sulfonyl-4-methyl-benzoate CAS Name: 3-[4-(1,3-dithiolan-2-yl)-2-methoxyphenoxy]sulfonyl-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[4-(1,3-dithiolan-2-yl)-2-methoxyphenoxy]sulfonyl-4-methylbenzoate Traditional Name: 3-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]sulfonyl-4-methyl-benzoic acid methyl ester Formula: C19H20O6S3 MolecularWeight: 440.5535

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O6S3/c1-12-4-5-13(18(20)24-3)11-17(12)28(21,22)25-15-7-6-14(10-16(15)23-2)19-26-8-9-27-19/h4-7,10-11,19H,8-9H2,1-3H3