(2,5-dimethoxyphenyl)methyl 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2,5-dimethoxyphenyl)methyl 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid (2,5-dimethoxybenzyl) ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)OCC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)OCC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C20H23NO5S/c1-21(2)19(22)13-27-18-8-6-5-7-16(18)20(23)26-12-14-11-15(24-3)9-10-17(14)25-4/h5-11H,12-13H2,1-4H3