(3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 3-ethoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-ethoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-keto-2-morpholino-ethoxy)benzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C21H26N2O7 MolecularWeight: 418.44034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC2=C(ON=C2C)C)OCC(=O)N3CCOCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC2=C(ON=C2C)C)OCC(=O)N3CCOCC3

InChI

InChI=1S/C21H26N2O7/c1-4-27-19-11-16(21(25)29-12-17-14(2)22-30-15(17)3)5-6-18(19)28-13-20(24)23-7-9-26-10-8-23/h5-6,11H,4,7-10,12-13H2,1-3H3