methyl 2-[[4-oxidanylidene-4-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethoxy]butanoyl]amino]benzoate

Systemtic Name: methyl 2-[[4-oxidanylidene-4-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethoxy]butanoyl]amino]benzoate Openeye Name: methyl 2-[[4-oxo-4-[2-oxo-2-(pyrimidin-2-ylamino)ethoxy]butanoyl]amino]benzoate CAS Name: 2-[[1,4-dioxo-4-[2-oxo-2-(2-pyrimidinylamino)ethoxy]butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-oxo-4-[2-oxo-2-(pyrimidin-2-ylamino)ethoxy]butanoyl]amino]benzoate Traditional Name: 2-[[4-keto-4-[2-keto-2-(2-pyrimidylamino)ethoxy]butanoyl]amino]benzoic acid methyl ester Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCC(=O)OCC(=O)NC2=NC=CC=N2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCC(=O)OCC(=O)NC2=NC=CC=N2

InChI

InChI=1S/C18H18N4O6/c1-27-17(26)12-5-2-3-6-13(12)21-14(23)7-8-16(25)28-11-15(24)22-18-19-9-4-10-20-18/h2-6,9-10H,7-8,11H2,1H3,(H,21,23)(H,19,20,22,24)