ethyl 2-[6-aminocarbonyl-9-(3-methoxyphenyl)-2-methyl-8-oxidanylidene-purin-7-yl]ethanoate

Systemtic Name: ethyl 2-[6-aminocarbonyl-9-(3-methoxyphenyl)-2-methyl-8-oxidanylidene-purin-7-yl]ethanoate Openeye Name: ethyl 2-[6-carbamoyl-9-(3-methoxyphenyl)-2-methyl-8-oxo-purin-7-yl]acetate CAS Name: 2-[6-carbamoyl-9-(3-methoxyphenyl)-2-methyl-8-oxo-7-purinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-carbamoyl-9-(3-methoxyphenyl)-2-methyl-8-oxopurin-7-yl]acetate Traditional Name: 2-[6-carbamoyl-8-keto-9-(3-methoxyphenyl)-2-methyl-purin-7-yl]acetic acid ethyl ester Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(N=C(N=C2N(C1=O)C3=CC(=CC=C3)OC)C)C(=O)N

Isomeric SMILES

CCOC(=O)CN1C2=C(N=C(N=C2N(C1=O)C3=CC(=CC=C3)OC)C)C(=O)N

InChI

InChI=1S/C18H19N5O5/c1-4-28-13(24)9-22-15-14(16(19)25)20-10(2)21-17(15)23(18(22)26)11-6-5-7-12(8-11)27-3/h5-8H,4,9H2,1-3H3,(H2,19,25)