2-[(2R)-1-cyclohexyl-4-(quinolin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2R)-1-cyclohexyl-4-(quinolin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2R)-1-cyclohexyl-4-(2-quinolylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2R)-1-cyclohexyl-4-(2-quinolinylmethyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2R)-1-cyclohexyl-4-(quinolin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2R)-1-cyclohexyl-4-(2-quinolylmethyl)piperazin-1-ium-2-yl]ethanol Formula: C22H32N3O+ MolecularWeight: 354.50898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2CCO)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(C[C@H]2CCO)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H31N3O/c26-15-12-21-17-24(13-14-25(21)20-7-2-1-3-8-20)16-19-11-10-18-6-4-5-9-22(18)23-19/h4-6,9-11,20-21,26H,1-3,7-8,12-17H2/p+1/t21-/m1/s1