ethyl 1-[1-(7H-purin-6-yl)piperidin-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-(7H-purin-6-yl)piperidin-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(7H-purin-6-yl)piperidine-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[1-(7H-purin-6-yl)-4-piperidinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(7H-purin-6-yl)piperidine-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(7H-purin-6-yl)isonipecotoyl]isonipecotic acid ethyl ester Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C19H26N6O3/c1-2-28-19(27)14-5-9-25(10-6-14)18(26)13-3-7-24(8-4-13)17-15-16(21-11-20-15)22-12-23-17/h11-14H,2-10H2,1H3,(H,20,21,22,23)