methyl 4-[2-(2,3-dithiophen-2-ylprop-2-enoyloxy)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2,3-dithiophen-2-ylprop-2-enoyloxy)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2,3-bis(2-thienyl)prop-2-enoyloxy]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(1-oxo-2,3-dithiophen-2-ylprop-2-enoxy)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2,3-dithiophen-2-ylprop-2-enoyloxy)acetyl]amino]benzoate Traditional Name: 4-[[2-[2,3-bis(2-thienyl)acryloyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C21H17NO5S2 MolecularWeight: 427.49338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CS2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CS2)C3=CC=CS3

InChI

InChI=1S/C21H17NO5S2/c1-26-20(24)14-6-8-15(9-7-14)22-19(23)13-27-21(25)17(18-5-3-11-29-18)12-16-4-2-10-28-16/h2-12H,13H2,1H3,(H,22,23)