ethyl-[1-[[(3R)-1-ethylpiperidin-1-ium-3-yl]methyl]piperidin-4-yl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[1-[[(3R)-1-ethylpiperidin-1-ium-3-yl]methyl]piperidin-4-yl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[1-[[(3R)-1-ethylpiperidin-1-ium-3-yl]methyl]-4-piperidyl]ammonium CAS Name: ethyl-[1-[[(3R)-1-ethyl-3-piperidin-1-iumyl]methyl]-4-piperidinyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[1-[[(3R)-1-ethylpiperidin-1-ium-3-yl]methyl]piperidin-4-yl]azanium Traditional Name: benzyl-ethyl-[1-[[(3R)-1-ethylpiperidin-1-ium-3-yl]methyl]-4-piperidyl]ammonium Formula: C22H39N3+2 MolecularWeight: 345.56516

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC(C1)CN2CCC(CC2)[NH+](CC)CC3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCC[C@@H](C1)CN2CCC(CC2)[NH+](CC)CC3=CC=CC=C3

InChI

InChI=1S/C22H37N3/c1-3-23-14-8-11-21(17-23)18-24-15-12-22(13-16-24)25(4-2)19-20-9-6-5-7-10-20/h5-7,9-10,21-22H,3-4,8,11-19H2,1-2H3/p+2/t21-/m0/s1