(4-pyrazol-1-ylphenyl)methyl 4-(2-oxidanylidenepiperidin-1-yl)benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 4-(2-oxidanylidenepiperidin-1-yl)benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 4-(2-oxo-1-piperidyl)benzoate CAS Name: 4-(2-oxo-1-piperidinyl)benzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 4-(2-oxopiperidin-1-yl)benzoate Traditional Name: 4-(2-ketopiperidino)benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H21N3O3/c26-21-4-1-2-14-24(21)19-11-7-18(8-12-19)22(27)28-16-17-5-9-20(10-6-17)25-15-3-13-23-25/h3,5-13,15H,1-2,4,14,16H2