ethyl 5-methyl-1-[3-(quinolin-2-ylcarbonylamino)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[3-(quinolin-2-ylcarbonylamino)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[3-(quinoline-2-carbonylamino)phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[3-[[oxo(2-quinolinyl)methyl]amino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[3-(quinoline-2-carbonylamino)phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[3-(quinaldoylamino)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=NC4=CC=CC=C4C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=NC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C23H20N4O3/c1-3-30-23(29)19-14-24-27(15(19)2)18-9-6-8-17(13-18)25-22(28)21-12-11-16-7-4-5-10-20(16)26-21/h4-14H,3H2,1-2H3,(H,25,28)