1,3-benzodioxol-5-yl 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: 1,3-benzodioxol-5-yl 3-ethoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-ethoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-keto-2-morpholino-ethoxy)benzoic acid 1,3-benzodioxol-5-yl ester Formula: C22H23NO8 MolecularWeight: 429.41992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)OCO3)OCC(=O)N4CCOCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)OCO3)OCC(=O)N4CCOCC4

InChI

InChI=1S/C22H23NO8/c1-2-27-19-11-15(22(25)31-16-4-6-18-20(12-16)30-14-29-18)3-5-17(19)28-13-21(24)23-7-9-26-10-8-23/h3-6,11-12H,2,7-10,13-14H2,1H3