tert-butyl 4-[benzamidooxy-(5-chloranylpyridin-2-yl)methyl]piperidine-2-carboxylate

Systemtic Name: tert-butyl 4-[benzamidooxy-(5-chloranylpyridin-2-yl)methyl]piperidine-2-carboxylate Openeye Name: tert-butyl 4-[benzamidooxy-(5-chloro-2-pyridyl)methyl]piperidine-2-carboxylate CAS Name: 4-[benzamidooxy-(5-chloro-2-pyridinyl)methyl]-2-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[benzamidooxy-(5-chloropyridin-2-yl)methyl]piperidine-2-carboxylate Traditional Name: 4-[benzamidooxy-(5-chloro-2-pyridyl)methyl]pipecolinic acid tert-butyl ester Formula: C23H28ClN3O4 MolecularWeight: 445.93912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(CCN1)C(C2=NC=C(C=C2)Cl)ONC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1CC(CCN1)C(C2=NC=C(C=C2)Cl)ONC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28ClN3O4/c1-23(2,3)30-22(29)19-13-16(11-12-25-19)20(18-10-9-17(24)14-26-18)31-27-21(28)15-7-5-4-6-8-15/h4-10,14,16,19-20,25H,11-13H2,1-3H3,(H,27,28)