(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 3-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 3-phenyl-1H-pyrazole-5-carboxylate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 3-phenyl-1H-pyrazole-5-carboxylate CAS Name: 3-phenyl-1H-pyrazole-5-carboxylic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 3-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 3-phenyl-1H-pyrazole-5-carboxylic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O5/c1-13(26)23-16-7-8-17-15(9-21(27)30-20(17)10-16)12-29-22(28)19-11-18(24-25-19)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,23,26)(H,24,25)