(phenylmethyl) 2-(6-chloranylpyridin-3-yl)carbonylpyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(6-chloranylpyridin-3-yl)carbonylpyrazolidine-1-carboxylate Openeye Name: benzyl 2-(6-chloropyridine-3-carbonyl)pyrazolidine-1-carboxylate CAS Name: 2-[(6-chloro-3-pyridinyl)-oxomethyl]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-chloropyridine-3-carbonyl)pyrazolidine-1-carboxylate Traditional Name: 2-(6-chloronicotinoyl)pyrazolidine-1-carboxylic acid benzyl ester Formula: C17H16ClN3O3 MolecularWeight: 345.78024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3O3/c18-15-8-7-14(11-19-15)16(22)20-9-4-10-21(20)17(23)24-12-13-5-2-1-3-6-13/h1-3,5-8,11H,4,9-10,12H2