ethyl 5-[2-(2-nitrophenoxy)ethanoylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(2-nitrophenoxy)ethanoylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-(2-nitrophenoxy)acetyl]amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(2-nitrophenoxy)acetyl]amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[[2-(2-nitrophenoxy)acetyl]amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C23H19N5O6 MolecularWeight: 461.42686

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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=C4[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O6/c1-2-33-23(30)16-13-24-27(20-12-11-15-7-3-4-8-17(15)25-20)22(16)26-21(29)14-34-19-10-6-5-9-18(19)28(31)32/h3-13H,2,14H2,1H3,(H,26,29)