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

Systemtic Name: 1,3-benzodioxol-5-yl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: 1,3-benzodioxol-5-yl 3-methoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 4-(2-keto-2-morpholino-ethoxy)-3-methoxy-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C21H21NO8 MolecularWeight: 415.39334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)OCO3)OCC(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)OCO3)OCC(=O)N4CCOCC4

InChI

InChI=1S/C21H21NO8/c1-25-18-10-14(21(24)30-15-3-5-17-19(11-15)29-13-28-17)2-4-16(18)27-12-20(23)22-6-8-26-9-7-22/h2-5,10-11H,6-9,12-13H2,1H3