(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-(2-thiophen-2-ylethanoylamino)benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-(2-thiophen-2-ylethanoylamino)benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 4,5-dimethoxy-2-[[2-(2-thienyl)acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 4,5-dimethoxy-2-[(2-thiophen-2-ylacetyl)amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[2-(2-thienyl)acetyl]amino]benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N2CCOCC2)NC(=O)CC3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N2CCOCC2)NC(=O)CC3=CC=CS3)OC

InChI

InChI=1S/C21H24N2O7S/c1-27-17-11-15(21(26)30-13-20(25)23-5-7-29-8-6-23)16(12-18(17)28-2)22-19(24)10-14-4-3-9-31-14/h3-4,9,11-12H,5-8,10,13H2,1-2H3,(H,22,24)