piperidin-1-yl-[4-[1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone

Systemtic Name: piperidin-1-yl-[4-[1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Openeye Name: 1-piperidyl-[4-[1-(thiazol-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone CAS Name: 1-piperidinyl-[4-[[1-(2-thiazolylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]methanone IUPAC Name: piperidin-1-yl-[4-[1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: piperidino-[4-[1-(thiazol-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Formula: C21H28N3O2S+ MolecularWeight: 386.53092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=NC=CS4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=NC=CS4

InChI

InChI=1S/C21H27N3O2S/c25-21(24-11-2-1-3-12-24)17-4-6-18(7-5-17)26-19-8-13-23(14-9-19)16-20-22-10-15-27-20/h4-7,10,15,19H,1-3,8-9,11-14,16H2/p+1