propyl 5-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanoylamino]-2-morpholin-4-yl-benzoate

Systemtic Name: propyl 5-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanoylamino]-2-morpholin-4-yl-benzoate Openeye Name: propyl 5-[[2-(2-bromo-4,6-dimethyl-phenoxy)acetyl]amino]-2-morpholino-benzoate CAS Name: 5-[[2-(2-bromo-4,6-dimethylphenoxy)-1-oxoethyl]amino]-2-(4-morpholinyl)benzoic acid propyl ester IUPAC Name: propyl 5-[[2-(2-bromo-4,6-dimethylphenoxy)acetyl]amino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[[2-(2-bromo-4,6-dimethyl-phenoxy)acetyl]amino]-2-morpholino-benzoic acid propyl ester Formula: C24H29BrN2O5 MolecularWeight: 505.40146

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)COC2=C(C=C(C=C2Br)C)C)N3CCOCC3

Isomeric SMILES

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)COC2=C(C=C(C=C2Br)C)C)N3CCOCC3

InChI

InChI=1S/C24H29BrN2O5/c1-4-9-31-24(29)19-14-18(5-6-21(19)27-7-10-30-11-8-27)26-22(28)15-32-23-17(3)12-16(2)13-20(23)25/h5-6,12-14H,4,7-11,15H2,1-3H3,(H,26,28)