1-[4-(2-oxidanyl-3-piperidin-1-yl-propyl)-4-(phenylmethyl)piperazin-4-ium-1-yl]-3-piperidin-1-yl-propan-2-ol

Systemtic Name: 1-[4-(2-oxidanyl-3-piperidin-1-yl-propyl)-4-(phenylmethyl)piperazin-4-ium-1-yl]-3-piperidin-1-yl-propan-2-ol Openeye Name: 1-[4-benzyl-4-[2-hydroxy-3-(1-piperidyl)propyl]piperazin-4-ium-1-yl]-3-(1-piperidyl)propan-2-ol CAS Name: 1-[4-[2-hydroxy-3-(1-piperidinyl)propyl]-4-(phenylmethyl)-1-piperazin-4-iumyl]-3-(1-piperidinyl)-2-propanol IUPAC Name: 1-[4-benzyl-4-(2-hydroxy-3-piperidin-1-ylpropyl)piperazin-4-ium-1-yl]-3-piperidin-1-ylpropan-2-ol Traditional Name: 1-[4-benzyl-4-(2-hydroxy-3-piperidino-propyl)piperazin-4-ium-1-yl]-3-piperidino-propan-2-ol Formula: C27H47N4O2+ MolecularWeight: 459.68768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN2CC[N+](CC2)(CC3=CC=CC=C3)CC(CN4CCCCC4)O)O

Isomeric SMILES

C1CCN(CC1)CC(CN2CC[N+](CC2)(CC3=CC=CC=C3)CC(CN4CCCCC4)O)O

InChI

InChI=1S/C27H47N4O2/c32-26(20-28-12-6-2-7-13-28)21-30-16-18-31(19-17-30,23-25-10-4-1-5-11-25)24-27(33)22-29-14-8-3-9-15-29/h1,4-5,10-11,26-27,32-33H,2-3,6-9,12-24H2/q+1