methyl 4-[2-[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(5-bromo-2,4-dioxo-pyrimidin-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(5-bromo-2,4-dioxo-1-pyrimidinyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5-bromo-2,4-dioxopyrimidin-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(5-bromo-2,4-diketo-pyrimidin-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C14H12BrN3O5 MolecularWeight: 382.16618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C(=O)NC2=O)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C(=O)NC2=O)Br

InChI

InChI=1S/C14H12BrN3O5/c1-23-13(21)8-2-4-9(5-3-8)16-11(19)7-18-6-10(15)12(20)17-14(18)22/h2-6H,7H2,1H3,(H,16,19)(H,17,20,22)