(1-methoxy-1-oxidanylidene-propan-2-yl) 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (1-methoxy-1-oxidanylidene-propan-2-yl) 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-methoxy-1-methyl-2-oxo-ethyl) 2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]benzoic acid (1-methoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-methoxy-1-oxopropan-2-yl) 2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(m-anisidino)ethyl]thio]benzoic acid (2-keto-2-methoxy-1-methyl-ethyl) ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C(=O)OC)OC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C20H21NO6S/c1-13(19(23)26-3)27-20(24)16-9-4-5-10-17(16)28-12-18(22)21-14-7-6-8-15(11-14)25-2/h4-11,13H,12H2,1-3H3,(H,21,22)