methyl 2-[2-[(2-ethyl-3-oxamoyl-1-benzothiophen-4-yl)oxy]ethanoylamino]propanoate

Systemtic Name: methyl 2-[2-[(2-ethyl-3-oxamoyl-1-benzothiophen-4-yl)oxy]ethanoylamino]propanoate Openeye Name: methyl 2-[[2-(2-ethyl-3-oxamoyl-benzothiophen-4-yl)oxyacetyl]amino]propanoate CAS Name: 2-[[2-[(2-ethyl-3-oxamoyl-1-benzothiophen-4-yl)oxy]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-ethyl-3-oxamoyl-1-benzothiophen-4-yl)oxy]acetyl]amino]propanoate Traditional Name: 2-[[2-(2-ethyl-3-oxamoyl-benzothiophen-4-yl)oxyacetyl]amino]propionic acid methyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=CC=C2S1)OCC(=O)NC(C)C(=O)OC)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(C=CC=C2S1)OCC(=O)NC(C)C(=O)OC)C(=O)C(=O)N

InChI

InChI=1S/C18H20N2O6S/c1-4-11-15(16(22)17(19)23)14-10(6-5-7-12(14)27-11)26-8-13(21)20-9(2)18(24)25-3/h5-7,9H,4,8H2,1-3H3,(H2,19,23)(H,20,21)