(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)benzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OCC(=O)N3CCCC3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OCC(=O)N3CCCC3)C

InChI

InChI=1S/C18H21N3O3/c1-13-11-14(2)21(19-13)16-7-5-15(6-8-16)18(23)24-12-17(22)20-9-3-4-10-20/h5-8,11H,3-4,9-10,12H2,1-2H3