methyl 4-[2-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]ethyl]benzoate CAS Name: 4-[2-[[1-oxo-2-(2-oxo-1-pyrimidinyl)ethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-(2-ketopyrimidin-1-yl)acetyl]amino]ethyl]benzoic acid methyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)CN2C=CC=NC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)CN2C=CC=NC2=O

InChI

InChI=1S/C16H17N3O4/c1-23-15(21)13-5-3-12(4-6-13)7-9-17-14(20)11-19-10-2-8-18-16(19)22/h2-6,8,10H,7,9,11H2,1H3,(H,17,20)