1-(7H-purin-6-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(7H-purin-6-yl)piperidine-4-carboxylic acid Openeye Name: 1-(7H-purin-6-yl)piperidine-4-carboxylic acid CAS Name: 1-(7H-purin-6-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(7H-purin-6-yl)piperidine-4-carboxylic acid Traditional Name: 1-(7H-purin-6-yl)isonipecotic acid Formula: C11H13N5O2 MolecularWeight: 247.25322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC=NC3=C2NC=N3

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC=NC3=C2NC=N3

InChI

InChI=1S/C11H13N5O2/c17-11(18)7-1-3-16(4-2-7)10-8-9(13-5-12-8)14-6-15-10/h5-7H,1-4H2,(H,17,18)(H,12,13,14,15)