3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 2-(2-phenoxyethanoylamino)ethanoate

Systemtic Name: 3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 2-(2-phenoxyethanoylamino)ethanoate Openeye Name: 3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propyl 2-[(2-phenoxyacetyl)amino]acetate CAS Name: 2-[(1-oxo-2-phenoxyethyl)amino]acetic acid 3-(3,7-dimethyl-2,6-dioxo-1-purinyl)propyl ester IUPAC Name: 3-(3,7-dimethyl-2,6-dioxopurin-1-yl)propyl 2-[(2-phenoxyacetyl)amino]acetate Traditional Name: 2-[(2-phenoxyacetyl)amino]acetic acid 3-(2,6-diketo-3,7-dimethyl-purin-1-yl)propyl ester Formula: C20H23N5O6 MolecularWeight: 429.42652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H23N5O6/c1-23-13-22-18-17(23)19(28)25(20(29)24(18)2)9-6-10-30-16(27)11-21-15(26)12-31-14-7-4-3-5-8-14/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,21,26)