ethyl 1-pyrimidin-2-ylpiperazin-1-ium-1-carboxylate

Systemtic Name: ethyl 1-pyrimidin-2-ylpiperazin-1-ium-1-carboxylate Openeye Name: ethyl 1-pyrimidin-2-ylpiperazin-1-ium-1-carboxylate CAS Name: 1-(2-pyrimidinyl)-1-piperazin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-pyrimidin-2-ylpiperazin-1-ium-1-carboxylate Traditional Name: 1-(2-pyrimidyl)piperazin-1-ium-1-carboxylic acid ethyl ester Formula: C11H17N4O2+ MolecularWeight: 237.27828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1(CCNCC1)C2=NC=CC=N2

Isomeric SMILES

CCOC(=O)[N+]1(CCNCC1)C2=NC=CC=N2

InChI

InChI=1S/C11H17N4O2/c1-2-17-11(16)15(8-6-12-7-9-15)10-13-4-3-5-14-10/h3-5,12H,2,6-9H2,1H3/q+1