methyl 5-bromanyl-2-[3-(furan-2-ylcarbonylamino)propanoylamino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[3-(furan-2-ylcarbonylamino)propanoylamino]benzoate Openeye Name: methyl 5-bromo-2-[3-(furan-2-carbonylamino)propanoylamino]benzoate CAS Name: 5-bromo-2-[[3-[[2-furanyl(oxo)methyl]amino]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[3-(furan-2-carbonylamino)propanoylamino]benzoate Traditional Name: 5-bromo-2-[3-(2-furoylamino)propanoylamino]benzoic acid methyl ester Formula: C16H15BrN2O5 MolecularWeight: 395.2047

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)CCNC(=O)C2=CC=CO2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)CCNC(=O)C2=CC=CO2

InChI

InChI=1S/C16H15BrN2O5/c1-23-16(22)11-9-10(17)4-5-12(11)19-14(20)6-7-18-15(21)13-3-2-8-24-13/h2-5,8-9H,6-7H2,1H3,(H,18,21)(H,19,20)