ethyl 5-[8-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]pentanoate

Systemtic Name: ethyl 5-[8-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]pentanoate Openeye Name: ethyl 5-(8-amino-1,3-dimethyl-2,6-dioxo-purin-7-yl)pentanoate CAS Name: 5-(8-amino-1,3-dimethyl-2,6-dioxo-7-purinyl)pentanoic acid ethyl ester IUPAC Name: ethyl 5-(8-amino-1,3-dimethyl-2,6-dioxopurin-7-yl)pentanoate Traditional Name: 5-(8-amino-2,6-diketo-1,3-dimethyl-purin-7-yl)valeric acid ethyl ester Formula: C14H21N5O4 MolecularWeight: 323.34764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C2=C(N=C1N)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCOC(=O)CCCCN1C2=C(N=C1N)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C14H21N5O4/c1-4-23-9(20)7-5-6-8-19-10-11(16-13(19)15)17(2)14(22)18(3)12(10)21/h4-8H2,1-3H3,(H2,15,16)