1-[4-[[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one

Systemtic Name: 1-[4-[[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one Openeye Name: 1-[4-[[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one CAS Name: 1-[4-[[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidin-1-iumyl]methyl]phenyl]-2-imidazolidinone IUPAC Name: 1-[4-[[(3R)-3-(hydroxymethyl)-3-phenethylpiperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one Traditional Name: 1-[4-[[(3R)-3-methylol-3-phenethyl-piperidin-1-ium-1-yl]methyl]phenyl]-2-imidazolidinone Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)N3CCNC3=O)(CCC4=CC=CC=C4)CO

Isomeric SMILES

C1C[C@@](C[NH+](C1)CC2=CC=C(C=C2)N3CCNC3=O)(CCC4=CC=CC=C4)CO

InChI

InChI=1S/C24H31N3O2/c28-19-24(13-11-20-5-2-1-3-6-20)12-4-15-26(18-24)17-21-7-9-22(10-8-21)27-16-14-25-23(27)29/h1-3,5-10,28H,4,11-19H2,(H,25,29)/p+1/t24-/m0/s1