2-[(2S)-1-(phenylmethyl)-4-(quinolin-8-ylmethyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-(phenylmethyl)-4-(quinolin-8-ylmethyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-benzyl-4-(8-quinolylmethyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(phenylmethyl)-4-(8-quinolinylmethyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-benzyl-4-(quinolin-8-ylmethyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-benzyl-4-(8-quinolylmethyl)piperazin-4-ium-2-yl]ethanol Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C[NH+]1CC2=CC=CC3=C2N=CC=C3)CCO)CC4=CC=CC=C4

Isomeric SMILES

C1CN([C@H](C[NH+]1CC2=CC=CC3=C2N=CC=C3)CCO)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O/c27-15-11-22-18-25(13-14-26(22)16-19-6-2-1-3-7-19)17-21-9-4-8-20-10-5-12-24-23(20)21/h1-10,12,22,27H,11,13-18H2/p+1/t22-/m0/s1