(phenylmethyl) 4-[[(2-chloranyl-6-methyl-pyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[(2-chloranyl-6-methyl-pyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[(2-chloro-6-methyl-pyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[(2-chloro-6-methyl-4-pyrimidinyl)amino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[(2-chloro-6-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(2-chloro-6-methyl-pyrimidin-4-yl)amino]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C19H23ClN4O2 MolecularWeight: 374.86452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)Cl)NCC2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)Cl)NCC2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H23ClN4O2/c1-14-11-17(23-18(20)22-14)21-12-15-7-9-24(10-8-15)19(25)26-13-16-5-3-2-4-6-16/h2-6,11,15H,7-10,12-13H2,1H3,(H,21,22,23)