methyl 4-methyl-3-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[(E)-3-(2-thienyl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[(E)-3-thiophen-2-ylprop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[(E)-3-(2-thienyl)acryloyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C=CC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C18H17NO5S/c1-12-5-6-13(18(22)23-2)10-15(12)19-16(20)11-24-17(21)8-7-14-4-3-9-25-14/h3-10H,11H2,1-2H3,(H,19,20)/b8-7+