[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-chloranyl-2-piperidin-1-yl-pyrimidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-chloranyl-2-piperidin-1-yl-pyrimidine-4-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 5-chloro-2-(1-piperidyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(1-piperidinyl)-4-pyrimidinecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 5-chloro-2-piperidin-1-ylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-piperidino-pyrimidine-4-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)OCC(=O)NCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)OCC(=O)NCC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H21ClN4O3/c20-15-12-22-19(24-9-5-2-6-10-24)23-17(15)18(26)27-13-16(25)21-11-14-7-3-1-4-8-14/h1,3-4,7-8,12H,2,5-6,9-11,13H2,(H,21,25)