[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-ethoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-keto-2-morpholino-ethoxy)benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C20H24N2O7 MolecularWeight: 404.41376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC#C)OCC(=O)N2CCOCC2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC#C)OCC(=O)N2CCOCC2

InChI

InChI=1S/C20H24N2O7/c1-3-7-21-18(23)13-29-20(25)15-5-6-16(17(12-15)27-4-2)28-14-19(24)22-8-10-26-11-9-22/h1,5-6,12H,4,7-11,13-14H2,2H3,(H,21,23)