(phenylmethyl) 4-[(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)methyl]piperidine-1-carboxylic acid benzyl ester Formula: C20H23N5O2 MolecularWeight: 365.42892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC=NC3=C2C=CN3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CNC2=NC=NC3=C2C=CN3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H23N5O2/c26-20(27-13-16-4-2-1-3-5-16)25-10-7-15(8-11-25)12-22-19-17-6-9-21-18(17)23-14-24-19/h1-6,9,14-15H,7-8,10-13H2,(H2,21,22,23,24)