(phenylmethyl) 2-iodanyl-4-(pyridin-4-ylcarbamoyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-iodanyl-4-(pyridin-4-ylcarbamoyl)piperidine-1-carboxylate Openeye Name: benzyl 2-iodo-4-(4-pyridylcarbamoyl)piperidine-1-carboxylate CAS Name: 2-iodo-4-[oxo-(pyridin-4-ylamino)methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-iodo-4-(pyridin-4-ylcarbamoyl)piperidine-1-carboxylate Traditional Name: 2-iodo-4-(4-pyridylcarbamoyl)piperidine-1-carboxylic acid benzyl ester Formula: C19H20IN3O3 MolecularWeight: 465.28487

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1C(=O)NC2=CC=NC=C2)I)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(CC1C(=O)NC2=CC=NC=C2)I)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H20IN3O3/c20-17-12-15(18(24)22-16-6-9-21-10-7-16)8-11-23(17)19(25)26-13-14-4-2-1-3-5-14/h1-7,9-10,15,17H,8,11-13H2,(H,21,22,24)