ethyl 4-[4-(5-fluoranyl-1-benzothiophen-3-yl)piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-(5-fluoranyl-1-benzothiophen-3-yl)piperidin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-(5-fluorobenzothiophen-3-yl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-(5-fluoro-1-benzothiophen-3-yl)-1-piperidinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(5-fluoro-1-benzothiophen-3-yl)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(5-fluorobenzothiophen-3-yl)piperidino]piperidine-1-carboxylic acid ethyl ester Formula: C21H27FN2O2S MolecularWeight: 390.514683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCC(CC2)C3=CSC4=C3C=C(C=C4)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCC(CC2)C3=CSC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H27FN2O2S/c1-2-26-21(25)24-11-7-17(8-12-24)23-9-5-15(6-10-23)19-14-27-20-4-3-16(22)13-18(19)20/h3-4,13-15,17H,2,5-12H2,1H3