ethyl 5-[2-(4-bromanylphenoxy)ethanoylamino]-2-morpholin-4-yl-benzoate

Systemtic Name: ethyl 5-[2-(4-bromanylphenoxy)ethanoylamino]-2-morpholin-4-yl-benzoate Openeye Name: ethyl 5-[[2-(4-bromophenoxy)acetyl]amino]-2-morpholino-benzoate CAS Name: 5-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-2-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 5-[[2-(4-bromophenoxy)acetyl]amino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[[2-(4-bromophenoxy)acetyl]amino]-2-morpholino-benzoic acid ethyl ester Formula: C21H23BrN2O5 MolecularWeight: 463.32172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Br)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Br)N3CCOCC3

InChI

InChI=1S/C21H23BrN2O5/c1-2-28-21(26)18-13-16(5-8-19(18)24-9-11-27-12-10-24)23-20(25)14-29-17-6-3-15(22)4-7-17/h3-8,13H,2,9-12,14H2,1H3,(H,23,25)