methyl 1-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]isonipecotic acid methyl ester Formula: C16H21N5O5 MolecularWeight: 363.36844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C16H21N5O5/c1-18-13-12(14(23)19(2)16(18)25)21(9-17-13)8-11(22)20-6-4-10(5-7-20)15(24)26-3/h9-10H,4-8H2,1-3H3