(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-pyrazol-1-ylbenzoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H14N2O5 MolecularWeight: 362.33556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C20H14N2O5/c23-16-6-7-17-14(10-19(24)27-18(17)11-16)12-26-20(25)13-2-4-15(5-3-13)22-9-1-8-21-22/h1-11,23H,12H2