1-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl 2-piperidin-1-ylethanoate

Systemtic Name: 1-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl 2-piperidin-1-ylethanoate Openeye Name: 1-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl 2-(1-piperidyl)acetate CAS Name: 2-(1-piperidinyl)acetic acid 1-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl ester IUPAC Name: 1-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl 2-piperidin-1-ylacetate Traditional Name: 2-piperidinoacetic acid 1-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethyl ester Formula: C16H23N5O4 MolecularWeight: 349.38492

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C=NC2=C1C(=O)N(C(=O)N2C)C)OC(=O)CN3CCCCC3

Isomeric SMILES

CC(N1C=NC2=C1C(=O)N(C(=O)N2C)C)OC(=O)CN3CCCCC3

InChI

InChI=1S/C16H23N5O4/c1-11(25-12(22)9-20-7-5-4-6-8-20)21-10-17-14-13(21)15(23)19(3)16(24)18(14)2/h10-11H,4-9H2,1-3H3