(4-acetamidophenyl) 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (4-acetamidophenyl) 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (4-acetamidophenyl) 2-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]benzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]benzoic acid (4-acetamidophenyl) ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SCC(=O)NCCOC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SCC(=O)NCCOC

InChI

InChI=1S/C20H22N2O5S/c1-14(23)22-15-7-9-16(10-8-15)27-20(25)17-5-3-4-6-18(17)28-13-19(24)21-11-12-26-2/h3-10H,11-13H2,1-2H3,(H,21,24)(H,22,23)