4-[1-[7-(1H-benzimidazol-2-yl)heptan-2-yl]piperidin-1-ium-1-yl]phenol

Systemtic Name: 4-[1-[7-(1H-benzimidazol-2-yl)heptan-2-yl]piperidin-1-ium-1-yl]phenol Openeye Name: 4-[1-[6-(1H-benzimidazol-2-yl)-1-methyl-hexyl]piperidin-1-ium-1-yl]phenol CAS Name: 4-[1-[7-(1H-benzimidazol-2-yl)heptan-2-yl]-1-piperidin-1-iumyl]phenol IUPAC Name: 4-[1-[7-(1H-benzimidazol-2-yl)heptan-2-yl]piperidin-1-ium-1-yl]phenol Traditional Name: 4-[1-[6-(1H-benzimidazol-2-yl)-1-methyl-hexyl]piperidin-1-ium-1-yl]phenol Formula: C25H34N3O+ MolecularWeight: 392.55696

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCC1=NC2=CC=CC=C2N1)[N+]3(CCCCC3)C4=CC=C(C=C4)O

Isomeric SMILES

CC(CCCCCC1=NC2=CC=CC=C2N1)[N+]3(CCCCC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C25H33N3O/c1-20(28(18-8-3-9-19-28)21-14-16-22(29)17-15-21)10-4-2-5-13-25-26-23-11-6-7-12-24(23)27-25/h6-7,11-12,14-17,20H,2-5,8-10,13,18-19H2,1H3,(H-,26,27,29)/p+1