2-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]-1-[(6-methylpyridin-2-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]-1-[(6-methylpyridin-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]-1-[(6-methyl-2-pyridyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-methyl-2-benzimidazolyl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]-1-[(6-methylpyridin-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]-1-[(6-methyl-2-pyridyl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C22H30N5O+ MolecularWeight: 380.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCN(CC2CCO)CC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCN(C[C@@H]2CCO)CC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C22H29N5O/c1-17-6-5-7-18(23-17)14-27-12-11-26(15-19(27)10-13-28)16-22-24-20-8-3-4-9-21(20)25(22)2/h3-9,19,28H,10-16H2,1-2H3/p+1/t19-/m0/s1