tert-butyl 4-[2-[4-(6-chloranylpyridin-3-yl)piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-(6-chloranylpyridin-3-yl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(6-chloro-3-pyridyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-(6-chloro-3-pyridinyl)-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(6-chloropyridin-3-yl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(6-chloro-3-pyridyl)piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H33ClN4O2 MolecularWeight: 408.96532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C21H33ClN4O2/c1-21(2,3)28-20(27)26-10-7-17(8-11-26)6-9-24-12-14-25(15-13-24)18-4-5-19(22)23-16-18/h4-5,16-17H,6-15H2,1-3H3