methyl 4-[2-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]ethyl]benzoate CAS Name: 4-[2-[[2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxoethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-[(5-bromo-2-furoyl)amino]acetyl]amino]ethyl]benzoic acid methyl ester Formula: C17H17BrN2O5 MolecularWeight: 409.23128

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)CNC(=O)C2=CC=C(O2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)CNC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C17H17BrN2O5/c1-24-17(23)12-4-2-11(3-5-12)8-9-19-15(21)10-20-16(22)13-6-7-14(18)25-13/h2-7H,8-10H2,1H3,(H,19,21)(H,20,22)