1-(6-azanyl-7H-purin-8-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(6-azanyl-7H-purin-8-yl)piperidine-4-carboxylic acid Openeye Name: 1-(6-amino-7H-purin-8-yl)piperidine-4-carboxylic acid CAS Name: 1-(6-amino-7H-purin-8-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(6-amino-7H-purin-8-yl)piperidine-4-carboxylic acid Traditional Name: 1-(6-amino-7H-purin-8-yl)isonipecotic acid Formula: C11H14N6O2 MolecularWeight: 262.26786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC3=C(N2)C(=NC=N3)N

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC3=C(N2)C(=NC=N3)N

InChI

InChI=1S/C11H14N6O2/c12-8-7-9(14-5-13-8)16-11(15-7)17-3-1-6(2-4-17)10(18)19/h5-6H,1-4H2,(H,18,19)(H3,12,13,14,15,16)