2-[(2S)-4-[(1-ethylbenzimidazol-2-yl)methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(1-ethylbenzimidazol-2-yl)methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(1-ethylbenzimidazol-2-yl)methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-ethyl-2-benzimidazolyl)methyl]-1-phenethyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-ethylbenzimidazol-2-yl)methyl]-1-phenethylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(1-ethylbenzimidazol-2-yl)methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol Formula: C24H33N4O+ MolecularWeight: 393.54502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1CN3CC[NH+](C(C3)CCO)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1CN3CC[NH+]([C@H](C3)CCO)CCC4=CC=CC=C4

InChI

InChI=1S/C24H32N4O/c1-2-28-23-11-7-6-10-22(23)25-24(28)19-26-15-16-27(21(18-26)13-17-29)14-12-20-8-4-3-5-9-20/h3-11,21,29H,2,12-19H2,1H3/p+1/t21-/m0/s1