[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3/c26-21-7-4-14-24(21)18-9-11-20(12-10-18)28-22(27)13-8-17-15-23-25(16-17)19-5-2-1-3-6-19/h1-3,5-6,9-12,15-16H,4,7-8,13-14H2