ethyl 3-[4-(1-phenyl-5-propyl-pyrazol-4-yl)carbonylpiperazin-1-yl]quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[4-(1-phenyl-5-propyl-pyrazol-4-yl)carbonylpiperazin-1-yl]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-(1-phenyl-5-propyl-pyrazole-4-carbonyl)piperazin-1-yl]quinoxaline-2-carboxylate CAS Name: 3-[4-[oxo-(1-phenyl-5-propyl-4-pyrazolyl)methyl]-1-piperazinyl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(1-phenyl-5-propylpyrazole-4-carbonyl)piperazin-1-yl]quinoxaline-2-carboxylate Traditional Name: 3-[4-(1-phenyl-5-propyl-pyrazole-4-carbonyl)piperazino]quinoxaline-2-carboxylic acid ethyl ester Formula: C28H30N6O3 MolecularWeight: 498.5762

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C(=O)OCC

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C(=O)OCC

InChI

InChI=1S/C28H30N6O3/c1-3-10-24-21(19-29-34(24)20-11-6-5-7-12-20)27(35)33-17-15-32(16-18-33)26-25(28(36)37-4-2)30-22-13-8-9-14-23(22)31-26/h5-9,11-14,19H,3-4,10,15-18H2,1-2H3