(phenylmethyl) 4-[[[3-(aminomethyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[[3-(aminomethyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[[3-(aminomethyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[3-(aminomethyl)-2-pyrazinyl]amino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[[3-(aminomethyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[3-(aminomethyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C19H25N5O2 MolecularWeight: 355.4341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC=CN=C2CN)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC2=NC=CN=C2CN)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H25N5O2/c20-12-17-18(22-9-8-21-17)23-13-15-6-10-24(11-7-15)19(25)26-14-16-4-2-1-3-5-16/h1-5,8-9,15H,6-7,10-14,20H2,(H,22,23)