[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] quinoline-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] quinoline-2-carboxylate Openeye Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid [2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl] ester Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H19N5O3/c26-18(24-10-12-25(13-11-24)20-21-8-3-9-22-20)14-28-19(27)17-7-6-15-4-1-2-5-16(15)23-17/h1-9H,10-14H2