propyl 3-[2-(4-bromanyl-2-methanoyl-6-methoxy-phenoxy)ethanoylamino]benzoate

Systemtic Name: propyl 3-[2-(4-bromanyl-2-methanoyl-6-methoxy-phenoxy)ethanoylamino]benzoate Openeye Name: propyl 3-[[2-(4-bromo-2-formyl-6-methoxy-phenoxy)acetyl]amino]benzoate CAS Name: 3-[[2-(4-bromo-2-formyl-6-methoxyphenoxy)-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-[[2-(4-bromo-2-formyl-6-methoxyphenoxy)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-bromo-2-formyl-6-methoxy-phenoxy)acetyl]amino]benzoic acid propyl ester Formula: C20H20BrNO6 MolecularWeight: 450.2799

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2C=O)Br)OC

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2C=O)Br)OC

InChI

InChI=1S/C20H20BrNO6/c1-3-7-27-20(25)13-5-4-6-16(9-13)22-18(24)12-28-19-14(11-23)8-15(21)10-17(19)26-2/h4-6,8-11H,3,7,12H2,1-2H3,(H,22,24)