cyclohexyl 2-(4-oxidanylidene-1H-pyrazolo[4,3-c]pyridin-5-yl)-2-phenyl-ethanoate

Systemtic Name: cyclohexyl 2-(4-oxidanylidene-1H-pyrazolo[4,3-c]pyridin-5-yl)-2-phenyl-ethanoate Openeye Name: cyclohexyl 2-(4-oxo-1H-pyrazolo[4,3-c]pyridin-5-yl)-2-phenyl-acetate CAS Name: 2-(4-oxo-1H-pyrazolo[4,3-c]pyridin-5-yl)-2-phenylacetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(4-oxo-1H-pyrazolo[4,3-c]pyridin-5-yl)-2-phenylacetate Traditional Name: 2-(4-keto-1H-pyrazolo[4,3-c]pyridin-5-yl)-2-phenyl-acetic acid cyclohexyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C(C2=CC=CC=C2)N3C=CC4=C(C3=O)C=NN4

Isomeric SMILES

C1CCC(CC1)OC(=O)C(C2=CC=CC=C2)N3C=CC4=C(C3=O)C=NN4

InChI

InChI=1S/C20H21N3O3/c24-19-16-13-21-22-17(16)11-12-23(19)18(14-7-3-1-4-8-14)20(25)26-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,18H,2,5-6,9-10H2,(H,21,22)