[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 1-(5-cyano-2-pyridyl)piperidine-4-carboxylate CAS Name: 1-(5-cyano-2-pyridinyl)-4-piperidinecarboxylic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(5-cyano-2-pyridyl)isonipecotic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NNC(=O)C2=CC=CC=C2)C3=NC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NNC(=O)C2=CC=CC=C2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C21H21N5O4/c22-12-15-6-7-18(23-13-15)26-10-8-17(9-11-26)21(29)30-14-19(27)24-25-20(28)16-4-2-1-3-5-16/h1-7,13,17H,8-11,14H2,(H,24,27)(H,25,28)