(phenylmethyl) 4-[5-oxidanylidene-4-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[5-oxidanylidene-4-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate Openeye Name: benzyl 4-[5-oxo-4-(3-pyridylmethyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[5-oxo-4-(3-pyridinylmethyl)-1,3,4-oxadiazol-2-yl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[5-oxo-4-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[5-keto-4-(3-pyridylmethyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylic acid benzyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NN(C(=O)O2)CC3=CN=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NN(C(=O)O2)CC3=CN=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O4/c26-20(28-15-16-5-2-1-3-6-16)24-11-8-18(9-12-24)19-23-25(21(27)29-19)14-17-7-4-10-22-13-17/h1-7,10,13,18H,8-9,11-12,14-15H2