2-[2-[[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]amino]-2-oxidanylidene-ethoxy]ethyl benzoate

Systemtic Name: 2-[2-[[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]amino]-2-oxidanylidene-ethoxy]ethyl benzoate Openeye Name: 2-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)amino]-2-oxo-ethoxy]ethyl benzoate CAS Name: benzoic acid 2-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)amino]-2-oxoethoxy]ethyl ester IUPAC Name: 2-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)amino]-2-oxoethoxy]ethyl benzoate Traditional Name: benzoic acid 2-[2-[(2,6-diamino-4-keto-1H-pyrimidin-5-yl)amino]-2-keto-ethoxy]ethyl ester Formula: C15H17N5O5 MolecularWeight: 347.32598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOCC(=O)NC2=C(NC(=NC2=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOCC(=O)NC2=C(NC(=NC2=O)N)N

InChI

InChI=1S/C15H17N5O5/c16-12-11(13(22)20-15(17)19-12)18-10(21)8-24-6-7-25-14(23)9-4-2-1-3-5-9/h1-5H,6-8H2,(H,18,21)(H5,16,17,19,20,22)