(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-(3,5-dimethylpyrazol-1-yl)benzoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-(3,5-dimethylpyrazol-1-yl)benzoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 4-(3,5-dimethylpyrazol-1-yl)benzoate CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)benzoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 4-(3,5-dimethylpyrazol-1-yl)benzoate Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)benzoic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)OC)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)OC)C

InChI

InChI=1S/C23H20N2O5/c1-14-10-15(2)25(24-14)18-6-4-16(5-7-18)23(27)29-13-17-11-22(26)30-21-12-19(28-3)8-9-20(17)21/h4-12H,13H2,1-3H3