tert-butyl 3-[(6-chloranylpyridin-3-yl)methoxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(6-chloranylpyridin-3-yl)methoxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(6-chloro-3-pyridyl)methoxymethyl]piperidine-1-carboxylate CAS Name: 3-[(6-chloro-3-pyridinyl)methoxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(6-chloropyridin-3-yl)methoxymethyl]piperidine-1-carboxylate Traditional Name: 3-[(6-chloro-3-pyridyl)methoxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H25ClN2O3 MolecularWeight: 340.845

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)COCC2=CN=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)COCC2=CN=C(C=C2)Cl

InChI

InChI=1S/C17H25ClN2O3/c1-17(2,3)23-16(21)20-8-4-5-14(10-20)12-22-11-13-6-7-15(18)19-9-13/h6-7,9,14H,4-5,8,10-12H2,1-3H3