methyl 4-[2-(4-bromanyl-5-methanoyl-2-methoxy-phenoxy)ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-(4-bromanyl-5-methanoyl-2-methoxy-phenoxy)ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(4-bromo-5-formyl-2-methoxy-phenoxy)acetyl]amino]butanoate CAS Name: 4-[[2-(4-bromo-5-formyl-2-methoxyphenoxy)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-bromo-5-formyl-2-methoxyphenoxy)acetyl]amino]butanoate Traditional Name: 4-[[2-(4-bromo-5-formyl-2-methoxy-phenoxy)acetyl]amino]butyric acid methyl ester Formula: C15H18BrNO6 MolecularWeight: 388.21052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)C=O)OCC(=O)NCCCC(=O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)C=O)OCC(=O)NCCCC(=O)OC

InChI

InChI=1S/C15H18BrNO6/c1-21-12-7-11(16)10(8-18)6-13(12)23-9-14(19)17-5-3-4-15(20)22-2/h6-8H,3-5,9H2,1-2H3,(H,17,19)