dimethyl 5-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]carbonyloxybenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]carbonyloxybenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2-(2-amino-2-oxo-ethyl)sulfanylbenzoyl]oxybenzene-1,3-dicarboxylate CAS Name: 5-[[2-[(2-amino-2-oxoethyl)thio]phenyl]-oxomethoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-(2-amino-2-oxoethyl)sulfanylbenzoyl]oxybenzene-1,3-dicarboxylate Traditional Name: 5-[2-[(2-amino-2-keto-ethyl)thio]benzoyl]oxybenzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H17NO7S MolecularWeight: 403.40578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)OC(=O)C2=CC=CC=C2SCC(=O)N)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)OC(=O)C2=CC=CC=C2SCC(=O)N)C(=O)OC

InChI

InChI=1S/C19H17NO7S/c1-25-17(22)11-7-12(18(23)26-2)9-13(8-11)27-19(24)14-5-3-4-6-15(14)28-10-16(20)21/h3-9H,10H2,1-2H3,(H2,20,21)