[(3S)-1-(cyclohexylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(quinolin-3-ylmethyl)azanium

Systemtic Name: [(3S)-1-(cyclohexylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(quinolin-3-ylmethyl)azanium Openeye Name: [(3S)-1-(cyclohexylmethyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-(3-quinolylmethyl)ammonium CAS Name: [(3S)-1-(cyclohexylmethyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl-(3-quinolinylmethyl)ammonium IUPAC Name: [(3S)-1-(cyclohexylmethyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl-(quinolin-3-ylmethyl)azanium Traditional Name: [(3S)-1-(cyclohexylmethyl)-3-hydroxy-2-keto-3-piperidyl]methyl-(3-quinolylmethyl)ammonium Formula: C23H32N3O2+ MolecularWeight: 382.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CCCC(C2=O)(C[NH2+]CC3=CC4=CC=CC=C4N=C3)O

Isomeric SMILES

C1CCC(CC1)CN2CCC[C@@](C2=O)(C[NH2+]CC3=CC4=CC=CC=C4N=C3)O

InChI

InChI=1S/C23H31N3O2/c27-22-23(28,11-6-12-26(22)16-18-7-2-1-3-8-18)17-24-14-19-13-20-9-4-5-10-21(20)25-15-19/h4-5,9-10,13,15,18,24,28H,1-3,6-8,11-12,14,16-17H2/p+1/t23-/m0/s1