(2-ethoxyphenyl)methyl 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2-ethoxyphenyl)methyl 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-ethoxyphenyl)methyl 2-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]benzoic acid (2-ethoxyphenyl)methyl ester IUPAC Name: (2-ethoxyphenyl)methyl 2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]benzoic acid (2-ethoxybenzyl) ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1COC(=O)C2=CC=CC=C2SCC(=O)NCCOC

Isomeric SMILES

CCOC1=CC=CC=C1COC(=O)C2=CC=CC=C2SCC(=O)NCCOC

InChI

InChI=1S/C21H25NO5S/c1-3-26-18-10-6-4-8-16(18)14-27-21(24)17-9-5-7-11-19(17)28-15-20(23)22-12-13-25-2/h4-11H,3,12-15H2,1-2H3,(H,22,23)