(2-methylphenyl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: (2-methylphenyl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: o-tolylmethyl 3-methoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 4-(2-keto-2-morpholino-ethoxy)-3-methoxy-benzoic acid (2-methylbenzyl) ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)OC

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)OC

InChI

InChI=1S/C22H25NO6/c1-16-5-3-4-6-18(16)14-29-22(25)17-7-8-19(20(13-17)26-2)28-15-21(24)23-9-11-27-12-10-23/h3-8,13H,9-12,14-15H2,1-2H3