ethyl 1-[3-[(2-oxidanylidenechromen-3-yl)carbonylamino]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[3-[(2-oxidanylidenechromen-3-yl)carbonylamino]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[3-[(2-oxochromene-3-carbonyl)amino]phenyl]pyrazole-3-carboxylate CAS Name: 1-[3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(2-oxochromene-3-carbonyl)amino]phenyl]pyrazole-3-carboxylate Traditional Name: 1-[3-[(2-ketochromene-3-carbonyl)amino]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCOC(=O)C1=NN(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H17N3O5/c1-2-29-22(28)18-10-11-25(24-18)16-8-5-7-15(13-16)23-20(26)17-12-14-6-3-4-9-19(14)30-21(17)27/h3-13H,2H2,1H3,(H,23,26)