dimethyl 5-[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyloxy]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyloxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2-[(8-chloro-1-naphthyl)sulfanyl]acetyl]oxybenzene-1,3-dicarboxylate CAS Name: 5-[2-[(8-chloro-1-naphthalenyl)thio]-1-oxoethoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-(8-chloronaphthalen-1-yl)sulfanylacetyl]oxybenzene-1,3-dicarboxylate Traditional Name: 5-[2-[(8-chloro-1-naphthyl)thio]acetyl]oxybenzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H17ClO6S MolecularWeight: 444.88478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)OC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)OC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl)C(=O)OC

InChI

InChI=1S/C22H17ClO6S/c1-27-21(25)14-9-15(22(26)28-2)11-16(10-14)29-19(24)12-30-18-8-4-6-13-5-3-7-17(23)20(13)18/h3-11H,12H2,1-2H3