ethyl 2-[6-aminocarbonyl-8-oxidanylidene-9-(oxolan-2-ylmethyl)-2-phenyl-purin-7-yl]ethanoate

Systemtic Name: ethyl 2-[6-aminocarbonyl-8-oxidanylidene-9-(oxolan-2-ylmethyl)-2-phenyl-purin-7-yl]ethanoate Openeye Name: ethyl 2-[6-carbamoyl-8-oxo-2-phenyl-9-(tetrahydrofuran-2-ylmethyl)purin-7-yl]acetate CAS Name: 2-[6-carbamoyl-8-oxo-9-(2-oxolanylmethyl)-2-phenyl-7-purinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-carbamoyl-8-oxo-9-(oxolan-2-ylmethyl)-2-phenylpurin-7-yl]acetate Traditional Name: 2-[6-carbamoyl-8-keto-2-phenyl-9-(tetrahydrofurfuryl)purin-7-yl]acetic acid ethyl ester Formula: C21H23N5O5 MolecularWeight: 425.43782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(N=C(N=C2N(C1=O)CC3CCCO3)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CCOC(=O)CN1C2=C(N=C(N=C2N(C1=O)CC3CCCO3)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C21H23N5O5/c1-2-30-15(27)12-25-17-16(18(22)28)23-19(13-7-4-3-5-8-13)24-20(17)26(21(25)29)11-14-9-6-10-31-14/h3-5,7-8,14H,2,6,9-12H2,1H3,(H2,22,28)