ethyl 1-quinolin-2-yl-5-[2-(2,3,5-trimethylphenoxy)ethanoylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-quinolin-2-yl-5-[2-(2,3,5-trimethylphenoxy)ethanoylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-quinolyl)-5-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]pyrazole-4-carboxylate CAS Name: 5-[[1-oxo-2-(2,3,5-trimethylphenoxy)ethyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-quinolin-2-yl-5-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]pyrazole-4-carboxylate Traditional Name: 1-(2-quinolyl)-5-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)COC4=CC(=CC(=C4C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)COC4=CC(=CC(=C4C)C)C

InChI

InChI=1S/C26H26N4O4/c1-5-33-26(32)20-14-27-30(23-11-10-19-8-6-7-9-21(19)28-23)25(20)29-24(31)15-34-22-13-16(2)12-17(3)18(22)4/h6-14H,5,15H2,1-4H3,(H,29,31)