ethyl 4-[2-(1-ethyl-3-methyl-pyrazol-4-yl)quinolin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(1-ethyl-3-methyl-pyrazol-4-yl)quinolin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(1-ethyl-3-methyl-pyrazol-4-yl)quinoline-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(1-ethyl-3-methyl-4-pyrazolyl)-4-quinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1-ethyl-3-methylpyrazol-4-yl)quinoline-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(1-ethyl-3-methyl-pyrazol-4-yl)quinoline-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C23H27N5O3/c1-4-28-15-19(16(3)25-28)21-14-18(17-8-6-7-9-20(17)24-21)22(29)26-10-12-27(13-11-26)23(30)31-5-2/h6-9,14-15H,4-5,10-13H2,1-3H3