(phenylmethyl) 4-[3-(2-fluoranylethanoylamino)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-(2-fluoranylethanoylamino)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-[3-[(2-fluoroacetyl)amino]-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[3-[(2-fluoro-1-oxoethyl)amino]-2-pyridinyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-[(2-fluoroacetyl)amino]pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[(2-fluoroacetyl)amino]-2-pyridyl]piperazine-1-carboxylic acid benzyl ester Formula: C19H21FN4O3 MolecularWeight: 372.393443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)NC(=O)CF)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)NC(=O)CF)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H21FN4O3/c20-13-17(25)22-16-7-4-8-21-18(16)23-9-11-24(12-10-23)19(26)27-14-15-5-2-1-3-6-15/h1-8H,9-14H2,(H,22,25)