1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)isonipecotic acid Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C(=NC=N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CNC2=C1C(=NC=N2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C13H16N4O2/c1-8-6-14-11-10(8)12(16-7-15-11)17-4-2-9(3-5-17)13(18)19/h6-7,9H,2-5H2,1H3,(H,18,19)(H,14,15,16)