(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1-phenylpyrazol-4-yl)ethanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1-phenylpyrazol-4-yl)ethanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 2-(1-phenylpyrazol-4-yl)acetate CAS Name: 2-(1-phenyl-4-pyrazolyl)acetic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 2-(1-phenylpyrazol-4-yl)acetate Traditional Name: 2-(1-phenylpyrazol-4-yl)acetic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C21H16N2O5/c24-17-6-7-18-15(9-21(26)28-19(18)10-17)13-27-20(25)8-14-11-22-23(12-14)16-4-2-1-3-5-16/h1-7,9-12,24H,8,13H2