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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)C=CC2=CSC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)/C=C/C2=CSC=C2

InChI

InChI=1S/C18H17NO5S/c1-23-18(22)15-5-2-13(3-6-15)10-19-16(20)11-24-17(21)7-4-14-8-9-25-12-14/h2-9,12H,10-11H2,1H3,(H,19,20)/b7-4+