(4-pyrazol-1-ylphenyl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 3-(2-ketopyrrolidino)benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H19N3O3/c25-20-6-2-12-23(20)19-5-1-4-17(14-19)21(26)27-15-16-7-9-18(10-8-16)24-13-3-11-22-24/h1,3-5,7-11,13-14H,2,6,12,15H2