ethyl 5-[(2-oxidanylidenechromen-3-yl)carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(2-oxidanylidenechromen-3-yl)carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-oxochromene-3-carbonyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-oxochromene-3-carbonyl)amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[(2-ketochromene-3-carbonyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C25H18N4O5 MolecularWeight: 454.43422

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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)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H18N4O5/c1-2-33-24(31)18-14-26-29(21-12-11-15-7-3-5-9-19(15)27-21)22(18)28-23(30)17-13-16-8-4-6-10-20(16)34-25(17)32/h3-14H,2H2,1H3,(H,28,30)