(phenylmethyl) 4-[(7H-purin-6-ylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(7H-purin-6-ylamino)methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[(7H-purin-6-ylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[(7H-purin-6-ylamino)methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(7H-purin-6-ylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(7H-purin-6-ylamino)methyl]piperidine-1-carboxylic acid benzyl ester Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC=NC3=C2NC=N3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CNC2=NC=NC3=C2NC=N3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C19H22N6O2/c26-19(27-11-15-4-2-1-3-5-15)25-8-6-14(7-9-25)10-20-17-16-18(22-12-21-16)24-13-23-17/h1-5,12-14H,6-11H2,(H2,20,21,22,23,24)